Natural Product: NPC243483

Natural Product ID:  NPC243483
Common Name:   Nalorphine
IUPAC Name:   (4R,4aR,7S,7aR,12bS)-3-prop-2-enyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
Synonyms:   Nalorphine
Molecular Formula:   C19H21NO3
Standard InCHIKey:  UIQMVEYFGZJHCZ-SSTWWWIQSA-N
Standard InCHI:  InChI=1S/C19H21NO3/c1-2-8-20-9-7-19-12-4-6-15(22)18(19)23-17-14(21)5-3-11(16(17)19)10-13(12)20/h2-6,12-13,15,18,21-22H,1,7-10H2/t12-,13+,15-,18-,19-/m0/s1
Canonical SMILES:  C=CCN1CC[C@@]23[C@@H]4[C@H]1Cc1c3c(O[C@H]2[C@H](C=C4)O)c(cc1)O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO9498 Papaver somniferum Species Papaveraceae Eukaryota TM-MC*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT32 Organism Mus musculus Mus musculus ED50 = 0.6 mg/kg 6708055
NPT32 Organism Mus musculus Mus musculus ED50 = 9.9 mg/kg 6708055
NPT32 Organism Mus musculus Mus musculus AD50 = 2.6 mg/kg 6708055
NPT32 Organism Mus musculus Mus musculus ED50 = 0.7 mg/kg 2831363
NPT1069 Individual Protein Mu opioid receptor Rattus norvegicus Ki = 6.5 nM 2831363
NPT1075 Individual Protein Kappa opioid receptor Cavia porcellus Ki = 15 nM 2831363
NPT938 Organism Cavia porcellus Cavia porcellus IC50 = 24.3 nM 7205890
NPT32 Organism Mus musculus Mus musculus IC50 = 535 nM 7205890
NPT32 Organism Mus musculus Mus musculus ED50 = 1.4 umol/kg 3007760
NPT32 Organism Mus musculus Mus musculus ED50 = 2.04 umol/kg 3007760
NPT32 Organism Mus musculus Mus musculus ED50 = 828 umol/kg 2845084
NPT32 Organism Mus musculus Mus musculus AD50 = 2 uM/kg 2845084
NPT32 Organism Mus musculus Mus musculus ED50 = 1.22 mg/kg 7310820
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 0.86 mg/kg 7310820
NPT938 Organism Cavia porcellus Cavia porcellus IC50 = 51.3 nM 6310111
NPT32 Organism Mus musculus Mus musculus ED50 = 3.51 umol/kg 6166748
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.47 umol/kg 6166748
NPT2863 Protein Family Opioid receptor Mus musculus IC50 = 160 nM 6292421
NPT2863 Protein Family Opioid receptor Mus musculus IC50 = 59 nM 6292421
NPT32 Organism Mus musculus Mus musculus ED50 = 3.5 umol/kg 6796691
NPT3590 Protein Family Opioid receptor Rattus norvegicus ED50 = 2.5 umol/kg 6796691
NPT32 Organism Mus musculus Mus musculus ED50 = 3.5 umol/kg 7310822
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.5 umol/kg 7310822
NPT2 Others Unspecified Ratio = 1.4 6312042
NPT2 Others Unspecified Ratio = 1.9 6312042
NPT4389 Protein Family Opioid receptors; mu/kappa/delta Homo sapiens IC50 = 28 nM 6312042
NPT32 Organism Mus musculus Mus musculus ED50 = 3.51 umol/kg 6767032
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.47 umol/kg 6767032
NPT29 Organism Rattus norvegicus Rattus norvegicus Ratio = 1.42 6767032
NPT32 Organism Mus musculus Mus musculus ED50 = 1.22 mg/kg 7120287
NPT29 Organism Rattus norvegicus Rattus norvegicus AD50 = 0.86 mg/kg 7120287
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 735 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 625 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 93 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 48 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 5000 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 4000 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 2850 nM 1469697
NPT296 Individual Protein Sigma opioid receptor Homo sapiens IC50 = 1800 nM 1469697
NPT32 Organism Mus musculus Mus musculus ED50 = 3.51 umol/kg 7192744
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.47 umol/kg 7192744
NPT29 Organism Rattus norvegicus Rattus norvegicus Ratio = 1.42 7192744
NPT32 Organism Mus musculus Mus musculus ED50 = 9.9 mg/kg 17962026
NPT32 Organism Mus musculus Mus musculus ED50 = 0.6 mg/kg 17962026
NPT32 Organism Mus musculus Mus musculus ED50 = 2.6 mg/kg 17962026
NPT2 Others Unspecified EC50 = 20 nM 17962026
NPT272 Individual Protein Kappa opioid receptor Homo sapiens Ki = 0.38 nM 19027293
NPT271 Individual Protein Delta opioid receptor Homo sapiens Ki = 120 nM 19027293
NPT145 Individual Protein Mu opioid receptor Homo sapiens Ki = 0.19 nM 19027293
NPT2 Others Unspecified Ratio Ki = 0.5 19027293
NPT2 Others Unspecified Ratio Ki = 320 19027293
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 1345.9 nM PubChem BioAssay data set
NPT699 Individual Protein UDP-glucuronosyltransferase 1-10 Homo sapiens Activity = 0 pm/min/mg 10836148
NPT694 Individual Protein UDP-glucuronosyltransferase 1-3 Homo sapiens Activity = 51 pm/min/mg 10836148
NPT902 Individual Protein UDP-glucuronosyltransferase 1A4 Homo sapiens Activity = 0 pm/min/mg 10836148
NPT695 Individual Protein UDP-glucuronosyltransferase 1-8 Homo sapiens Activity = 75 pm/min/mg 10836148
NPT704 Individual Protein UDP-glucuronosyltransferase 2B15 Homo sapiens Activity = 0 pm/min/mg 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 1483 pm/min/mg 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 1051 pm/min/mg 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 134 pm/min/mg 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 3400 pm/min/mg 10836148
NPT100 Individual Protein Glutaminase kidney isoform, mitochondrial Homo sapiens Potency 28183.8 nM PubChem BioAssay data set
NPT2 Others Unspecified ID50 = 24.3 nM 73588
NPT3590 Protein Family Opioid receptor Rattus norvegicus EC50 = 1.5 nM 73588
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 1 mg/kg 73588
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 0.9 mg/kg 73588
NPT32 Organism Mus musculus Mus musculus ED50 = 1.45 mg/kg 73588
NPT32 Organism Mus musculus Mus musculus ED50 = 0.43 mg/kg 691001
NPT32 Organism Mus musculus Mus musculus ED50 = 2.8 mg/kg 722743
NPT29 Organism Rattus norvegicus Rattus norvegicus AD50 = 0.1 mg/kg 722743
NPT32 Organism Mus musculus Mus musculus ED50 = 0.77 mg/kg 845878
NPT32 Organism Mus musculus Mus musculus ED50 = 1.14 mg/kg 845878
NPT32 Organism Mus musculus Mus musculus ED50 = 0.58 mg/kg 845878
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 0.38 mg/kg 845878
NPT32 Organism Mus musculus Mus musculus ED50 = 2.8 mg/kg 16135
NPT29 Organism Rattus norvegicus Rattus norvegicus AD50 = 0.1 mg/kg 16135
NPT32 Organism Mus musculus Mus musculus ED50 = 2.8 mg/kg 31481
NPT32 Organism Mus musculus Mus musculus ED50 = 15 mg/kg 31481
NPT29 Organism Rattus norvegicus Rattus norvegicus AD50 = 0.1 mg/kg 31481
NPT29 Organism Rattus norvegicus Rattus norvegicus AD50 = 6 mg/kg 31481
NPT3590 Protein Family Opioid receptor Rattus norvegicus IC50 = 2 nM 207868
NPT3590 Protein Family Opioid receptor Rattus norvegicus IC50 = 6 nM 207868
NPT3590 Protein Family Opioid receptor Rattus norvegicus Ratio IC50 = 3 207868
NPT32 Organism Mus musculus Mus musculus ED50 = 3.2 umol/kg 207868
NPT32 Organism Mus musculus Mus musculus ED50 = 1 umol/kg 207868
NPT32 Organism Mus musculus Mus musculus ED50 = 4.8 mg/kg 21291
NPT32 Organism Mus musculus Mus musculus ED50 = 36.3 mg/kg 21291
NPT272 Individual Protein Kappa opioid receptor Homo sapiens Ki = 2 nM 26390077
NPT145 Individual Protein Mu opioid receptor Homo sapiens Ki = 0.36 nM 26390077

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC243483 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
0.9889 High Similarity NPC232533
0.9779 High Similarity NPC97086
0.967 High Similarity NPC43069
0.967 High Similarity NPC140577
0.962 High Similarity NPC126211
0.9563 High Similarity NPC67346
0.9358 High Similarity NPC157958
0.9341 High Similarity NPC174783
0.9091 High Similarity NPC311781
0.8649 High Similarity NPC214629
0.8486 Intermediate Similarity NPC298339
0.8402 Intermediate Similarity NPC201055
0.8402 Intermediate Similarity NPC254045
0.8402 Intermediate Similarity NPC64576
0.8402 Intermediate Similarity NPC151470
0.8387 Intermediate Similarity NPC115906
0.8177 Intermediate Similarity NPC196231
0.8115 Intermediate Similarity NPC162694
0.8103 Intermediate Similarity NPC66909
0.8043 Intermediate Similarity NPC124657
0.801 Intermediate Similarity NPC279665
0.799 Intermediate Similarity NPC244191
0.7906 Intermediate Similarity NPC305847
0.7892 Intermediate Similarity NPC255607
0.7892 Intermediate Similarity NPC3375
0.7879 Intermediate Similarity NPC293624
0.7868 Intermediate Similarity NPC33256
0.7865 Intermediate Similarity NPC302449
0.7749 Intermediate Similarity NPC35680
0.773 Intermediate Similarity NPC226428
0.7677 Intermediate Similarity NPC94499
0.7663 Intermediate Similarity NPC323443
0.7663 Intermediate Similarity NPC180756
0.7634 Intermediate Similarity NPC475780
0.761 Intermediate Similarity NPC80472
0.761 Intermediate Similarity NPC476500
0.7487 Intermediate Similarity NPC470324
0.7465 Intermediate Similarity NPC82056
0.7463 Intermediate Similarity NPC286135
0.7447 Intermediate Similarity NPC205167
0.7447 Intermediate Similarity NPC249274
0.7435 Intermediate Similarity NPC284842
0.7423 Intermediate Similarity NPC329969
0.7398 Intermediate Similarity NPC32154
0.738 Intermediate Similarity NPC147091
0.7371 Intermediate Similarity NPC38964
0.7368 Intermediate Similarity NPC324144
0.7358 Intermediate Similarity NPC263212
0.7354 Intermediate Similarity NPC27410
0.7354 Intermediate Similarity NPC18402
0.7354 Intermediate Similarity NPC166014
0.7351 Intermediate Similarity NPC8337
0.7351 Intermediate Similarity NPC85747
0.735 Intermediate Similarity NPC141440
0.7344 Intermediate Similarity NPC145832
0.7344 Intermediate Similarity NPC117188
0.7344 Intermediate Similarity NPC205421
0.7344 Intermediate Similarity NPC306555
0.7344 Intermediate Similarity NPC12053
0.7344 Intermediate Similarity NPC81218
0.7344 Intermediate Similarity NPC158376
0.7344 Intermediate Similarity NPC474931
0.733 Intermediate Similarity NPC13504
0.733 Intermediate Similarity NPC477563
0.733 Intermediate Similarity NPC136508
0.733 Intermediate Similarity NPC306843
0.733 Intermediate Similarity NPC253043
0.733 Intermediate Similarity NPC96603
0.733 Intermediate Similarity NPC78222
0.733 Intermediate Similarity NPC212794
0.733 Intermediate Similarity NPC35345
0.733 Intermediate Similarity NPC196447
0.732 Intermediate Similarity NPC227683
0.7317 Intermediate Similarity NPC207239
0.7317 Intermediate Similarity NPC267414
0.7312 Intermediate Similarity NPC475718
0.731 Intermediate Similarity NPC27887
0.7304 Intermediate Similarity NPC24228
0.73 Intermediate Similarity NPC230098
0.7296 Intermediate Similarity NPC241704
0.7286 Intermediate Similarity NPC94687
0.7286 Intermediate Similarity NPC476495
0.7286 Intermediate Similarity NPC106840
0.7277 Intermediate Similarity NPC1229
0.7277 Intermediate Similarity NPC476569
0.7273 Intermediate Similarity NPC115869
0.7268 Intermediate Similarity NPC83019
0.7263 Intermediate Similarity NPC135006
0.7259 Intermediate Similarity NPC114364
0.7259 Intermediate Similarity NPC320223
0.7251 Intermediate Similarity NPC46990
0.7245 Intermediate Similarity NPC128560
0.7245 Intermediate Similarity NPC229166
0.7245 Intermediate Similarity NPC199465
0.7243 Intermediate Similarity NPC469539
0.7243 Intermediate Similarity NPC469540
0.7238 Intermediate Similarity NPC326895
0.7236 Intermediate Similarity NPC233718
0.7222 Intermediate Similarity NPC126284
0.7222 Intermediate Similarity NPC474745
0.7222 Intermediate Similarity NPC149285
0.7222 Intermediate Similarity NPC99179
0.722 Intermediate Similarity NPC204580
0.7204 Intermediate Similarity NPC474556
0.7196 Intermediate Similarity NPC476443
0.7196 Intermediate Similarity NPC133817
0.7192 Intermediate Similarity NPC63152
0.7184 Intermediate Similarity NPC17677
0.7179 Intermediate Similarity NPC168753
0.7179 Intermediate Similarity NPC118274
0.7172 Intermediate Similarity NPC21885
0.7172 Intermediate Similarity NPC474325
0.717 Intermediate Similarity NPC476496
0.7165 Intermediate Similarity NPC298979
0.7163 Intermediate Similarity NPC471489
0.7158 Intermediate Similarity NPC180901
0.7158 Intermediate Similarity NPC78359
0.7158 Intermediate Similarity NPC300757
0.7158 Intermediate Similarity NPC315707
0.7158 Intermediate Similarity NPC65490
0.7158 Intermediate Similarity NPC148014
0.7158 Intermediate Similarity NPC40389
0.715 Intermediate Similarity NPC116284
0.715 Intermediate Similarity NPC248642
0.7143 Intermediate Similarity NPC239775
0.7143 Intermediate Similarity NPC131121
0.7135 Intermediate Similarity NPC228501
0.7129 Intermediate Similarity NPC8927
0.7128 Intermediate Similarity NPC164429
0.7128 Intermediate Similarity NPC470924
0.7123 Intermediate Similarity NPC207873
0.7123 Intermediate Similarity NPC100573
0.7121 Intermediate Similarity NPC237044
0.712 Intermediate Similarity NPC118804
0.712 Intermediate Similarity NPC288353
0.7115 Intermediate Similarity NPC474427
0.7114 Intermediate Similarity NPC156576
0.7114 Intermediate Similarity NPC474746
0.7114 Intermediate Similarity NPC475981
0.7113 Intermediate Similarity NPC476573
0.7113 Intermediate Similarity NPC35627
0.7113 Intermediate Similarity NPC81247
0.7108 Intermediate Similarity NPC226708
0.7107 Intermediate Similarity NPC192135
0.7107 Intermediate Similarity NPC66341
0.7107 Intermediate Similarity NPC477020
0.7098 Intermediate Similarity NPC21046
0.7098 Intermediate Similarity NPC472961
0.7098 Intermediate Similarity NPC472962
0.7092 Intermediate Similarity NPC329911
0.7092 Intermediate Similarity NPC26240
0.7092 Intermediate Similarity NPC69712
0.7092 Intermediate Similarity NPC477562
0.7085 Intermediate Similarity NPC148693
0.7085 Intermediate Similarity NPC118633
0.7085 Intermediate Similarity NPC294790
0.7083 Intermediate Similarity NPC4304
0.7077 Intermediate Similarity NPC210140
0.7077 Intermediate Similarity NPC181653
0.7077 Intermediate Similarity NPC190332
0.7074 Intermediate Similarity NPC472837
0.7071 Intermediate Similarity NPC304675
0.7068 Intermediate Similarity NPC478161
0.7068 Intermediate Similarity NPC478159
0.7065 Intermediate Similarity NPC47191
0.7056 Intermediate Similarity NPC186392
0.7056 Intermediate Similarity NPC129578
0.7056 Intermediate Similarity NPC476331
0.7053 Intermediate Similarity NPC474432
0.7053 Intermediate Similarity NPC475713
0.7049 Intermediate Similarity NPC138438
0.7049 Intermediate Similarity NPC908
0.7047 Intermediate Similarity NPC153631
0.7044 Intermediate Similarity NPC228209
0.7041 Intermediate Similarity NPC160570
0.7041 Intermediate Similarity NPC41689
0.7037 Intermediate Similarity NPC133011
0.7037 Intermediate Similarity NPC82285
0.7035 Intermediate Similarity NPC316292
0.7035 Intermediate Similarity NPC222524
0.703 Intermediate Similarity NPC135772
0.703 Intermediate Similarity NPC244903
0.703 Intermediate Similarity NPC104682
0.7024 Intermediate Similarity NPC240808
0.7021 Intermediate Similarity NPC68967
0.7019 Intermediate Similarity NPC46744
0.7019 Intermediate Similarity NPC124302
0.7019 Intermediate Similarity NPC70290
0.7019 Intermediate Similarity NPC73020
0.7019 Intermediate Similarity NPC215098
0.7019 Intermediate Similarity NPC14622
0.7015 Intermediate Similarity NPC312918
0.7015 Intermediate Similarity NPC476574
0.7015 Intermediate Similarity NPC155442
0.7015 Intermediate Similarity NPC477561
0.701 Intermediate Similarity NPC59567
0.701 Intermediate Similarity NPC320104
0.7009 Intermediate Similarity NPC315914
0.7005 Intermediate Similarity NPC255787
0.7005 Intermediate Similarity NPC191012

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC243483 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
1.0 High Similarity NPD3448 Approved
0.9889 High Similarity NPD2491 Approved
0.967 High Similarity NPD3533 Approved
0.967 High Similarity NPD2972 Approved
0.9563 High Similarity NPD3057 Approved
0.9263 High Similarity NPD5676 Approved
0.9091 High Similarity NPD4482 Phase 3
0.9037 High Similarity NPD4107 Approved
0.9031 High Similarity NPD4111 Phase 1
0.9031 High Similarity NPD4665 Approved
0.8945 High Similarity NPD5619 Clinical (unspecified phase)
0.8844 High Similarity NPD7907 Approved
0.8811 High Similarity NPD2490 Approved
0.8811 High Similarity NPD2488 Approved
0.8486 Intermediate Similarity NPD3534 Clinical (unspecified phase)
0.8402 Intermediate Similarity NPD3452 Approved
0.8402 Intermediate Similarity NPD3450 Approved
0.8389 Intermediate Similarity NPD7048 Phase 3
0.8387 Intermediate Similarity NPD2971 Approved
0.8387 Intermediate Similarity NPD2968 Approved
0.8367 Intermediate Similarity NPD4040 Phase 1
0.8366 Intermediate Similarity NPD5980 Discovery
0.8316 Intermediate Similarity NPD4004 Approved
0.8316 Intermediate Similarity NPD4002 Approved
0.8308 Intermediate Similarity NPD2493 Approved
0.8308 Intermediate Similarity NPD2494 Approved
0.8274 Intermediate Similarity NPD4582 Approved
0.8274 Intermediate Similarity NPD4583 Approved
0.8251 Intermediate Similarity NPD2489 Approved
0.8251 Intermediate Similarity NPD27 Approved
0.8103 Intermediate Similarity NPD2974 Approved
0.8103 Intermediate Similarity NPD2975 Approved
0.8103 Intermediate Similarity NPD2973 Approved
0.8098 Intermediate Similarity NPD2969 Approved
0.8098 Intermediate Similarity NPD2970 Approved
0.8071 Intermediate Similarity NPD4580 Approved
0.7946 Intermediate Similarity NPD3051 Approved
0.7906 Intermediate Similarity NPD7312 Approved
0.7906 Intermediate Similarity NPD7313 Approved
0.7906 Intermediate Similarity NPD7310 Approved
0.7906 Intermediate Similarity NPD7311 Approved
0.7874 Intermediate Similarity NPD7047 Phase 3
0.7865 Intermediate Similarity NPD7309 Approved
0.7736 Intermediate Similarity NPD6997 Phase 2
0.772 Intermediate Similarity NPD4578 Approved
0.772 Intermediate Similarity NPD4577 Approved
0.7692 Intermediate Similarity NPD4663 Approved
0.7672 Intermediate Similarity NPD4481 Phase 3
0.7563 Intermediate Similarity NPD7906 Approved
0.7487 Intermediate Similarity NPD2898 Approved
0.734 Intermediate Similarity NPD5616 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD6071 Discontinued
0.7198 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7177 Intermediate Similarity NPD7497 Discontinued
0.7158 Intermediate Similarity NPD2563 Approved
0.7158 Intermediate Similarity NPD2560 Approved
0.7136 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7128 Intermediate Similarity NPD4575 Clinical (unspecified phase)
0.7107 Intermediate Similarity NPD3050 Clinical (unspecified phase)
0.7092 Intermediate Similarity NPD3446 Phase 1
0.7087 Intermediate Similarity NPD7667 Clinical (unspecified phase)
0.7068 Intermediate Similarity NPD5978 Approved
0.7068 Intermediate Similarity NPD5977 Approved
0.7056 Intermediate Similarity NPD2163 Approved
0.7043 Intermediate Similarity NPD1754 Clinical (unspecified phase)
0.7019 Intermediate Similarity NPD4420 Approved
0.7018 Intermediate Similarity NPD8404 Phase 2
0.6976 Remote Similarity NPD5525 Clinical (unspecified phase)
0.6976 Remote Similarity NPD3808 Clinical (unspecified phase)
0.6968 Remote Similarity NPD3641 Approved
0.6968 Remote Similarity NPD3639 Approved
0.6968 Remote Similarity NPD3640 Phase 3
0.6961 Remote Similarity NPD7291 Discontinued
0.6947 Remote Similarity NPD1337 Clinical (unspecified phase)
0.6912 Remote Similarity NPD5038 Approved
0.6912 Remote Similarity NPD5037 Approved
0.6911 Remote Similarity NPD4773 Phase 2
0.6911 Remote Similarity NPD4772 Phase 2
0.6907 Remote Similarity NPD7833 Phase 2
0.6907 Remote Similarity NPD7831 Phase 2
0.6907 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6895 Remote Similarity NPD824 Approved
0.6887 Remote Similarity NPD5006 Approved
0.6887 Remote Similarity NPD5005 Approved
0.6884 Remote Similarity NPD7177 Discontinued
0.6878 Remote Similarity NPD6040 Clinical (unspecified phase)
0.6863 Remote Similarity NPD5036 Approved
0.6832 Remote Similarity NPD7038 Approved
0.6832 Remote Similarity NPD7039 Approved
0.6827 Remote Similarity NPD4466 Phase 1
0.6823 Remote Similarity NPD6386 Approved
0.6823 Remote Similarity NPD6385 Approved
0.681 Remote Similarity NPD5564 Approved
0.6791 Remote Similarity NPD5241 Discontinued
0.6788 Remote Similarity NPD7577 Discontinued
0.6782 Remote Similarity NPD3823 Discontinued
0.6763 Remote Similarity NPD6377 Clinical (unspecified phase)
0.6763 Remote Similarity NPD6836 Approved
0.6762 Remote Similarity NPD4362 Clinical (unspecified phase)
0.6762 Remote Similarity NPD4361 Phase 2
0.6749 Remote Similarity NPD5031 Approved
0.6749 Remote Similarity NPD5027 Approved
0.6749 Remote Similarity NPD5029 Approved
0.6748 Remote Similarity NPD3863 Clinical (unspecified phase)
0.6732 Remote Similarity NPD8053 Approved
0.6732 Remote Similarity NPD8054 Approved
0.673 Remote Similarity NPD7238 Clinical (unspecified phase)
0.6728 Remote Similarity NPD7701 Phase 2
0.672 Remote Similarity NPD2421 Approved
0.672 Remote Similarity NPD2420 Approved
0.6716 Remote Similarity NPD5026 Approved
0.6716 Remote Similarity NPD36 Approved
0.6716 Remote Similarity NPD5028 Approved
0.6716 Remote Similarity NPD4955 Approved
0.6716 Remote Similarity NPD5034 Approved
0.6716 Remote Similarity NPD4954 Approved
0.6714 Remote Similarity NPD4360 Phase 2
0.6714 Remote Similarity NPD4363 Phase 3
0.6702 Remote Similarity NPD7427 Discontinued
0.67 Remote Similarity NPD6167 Clinical (unspecified phase)
0.67 Remote Similarity NPD6166 Phase 2
0.67 Remote Similarity NPD6168 Clinical (unspecified phase)
0.6699 Remote Similarity NPD5968 Phase 3
0.6684 Remote Similarity NPD3882 Suspended
0.6683 Remote Similarity NPD42 Phase 2
0.6683 Remote Similarity NPD6042 Phase 2
0.6683 Remote Similarity NPD5312 Approved
0.6683 Remote Similarity NPD5313 Approved
0.6683 Remote Similarity NPD5844 Phase 1
0.6667 Remote Similarity NPD4666 Phase 3
0.6667 Remote Similarity NPD5030 Phase 2
0.6667 Remote Similarity NPD7922 Phase 1
0.665 Remote Similarity NPD7090 Clinical (unspecified phase)
0.665 Remote Similarity NPD8005 Clinical (unspecified phase)
0.6649 Remote Similarity NPD6028 Clinical (unspecified phase)
0.6649 Remote Similarity NPD6029 Clinical (unspecified phase)
0.6636 Remote Similarity NPD5457 Discontinued
0.6636 Remote Similarity NPD7607 Clinical (unspecified phase)
0.6632 Remote Similarity NPD2651 Approved
0.6632 Remote Similarity NPD2649 Approved
0.6616 Remote Similarity NPD5709 Phase 3
0.6615 Remote Similarity NPD1934 Approved
0.6615 Remote Similarity NPD6844 Discontinued
0.6612 Remote Similarity NPD3142 Approved
0.6612 Remote Similarity NPD3140 Approved
0.6602 Remote Similarity NPD5035 Approved
0.6602 Remote Similarity NPD4078 Clinical (unspecified phase)
0.6599 Remote Similarity NPD5019 Clinical (unspecified phase)
0.6597 Remote Similarity NPD4584 Approved
0.6587 Remote Similarity NPD8434 Phase 2
0.6582 Remote Similarity NPD2393 Clinical (unspecified phase)
0.6575 Remote Similarity NPD4859 Phase 1
0.6569 Remote Similarity NPD4956 Approved
0.6564 Remote Similarity NPD7109 Clinical (unspecified phase)
0.6564 Remote Similarity NPD6873 Phase 2
0.6564 Remote Similarity NPD7110 Phase 1
0.656 Remote Similarity NPD8161 Suspended
0.6553 Remote Similarity NPD5032 Approved
0.6552 Remote Similarity NPD7893 Clinical (unspecified phase)
0.6552 Remote Similarity NPD3818 Discontinued
0.6543 Remote Similarity NPD4664 Clinical (unspecified phase)
0.654 Remote Similarity NPD7296 Approved
0.6538 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6535 Remote Similarity NPD7278 Phase 2
0.6535 Remote Similarity NPD7279 Phase 2
0.6532 Remote Similarity NPD7827 Phase 1
0.6522 Remote Similarity NPD3110 Approved
0.6522 Remote Similarity NPD8469 Approved
0.6522 Remote Similarity NPD3109 Approved
0.652 Remote Similarity NPD4603 Phase 2
0.6517 Remote Similarity NPD7315 Approved
0.6515 Remote Similarity NPD4868 Clinical (unspecified phase)
0.6512 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6509 Remote Similarity NPD6181 Discontinued
0.6505 Remote Similarity NPD5039 Approved
0.65 Remote Similarity NPD5494 Approved
0.6497 Remote Similarity NPD5772 Approved
0.6497 Remote Similarity NPD5773 Approved
0.6497 Remote Similarity NPD6818 Clinical (unspecified phase)
0.6492 Remote Similarity NPD6666 Approved
0.6492 Remote Similarity NPD6667 Approved
0.649 Remote Similarity NPD6618 Phase 2
0.6488 Remote Similarity NPD5190 Phase 2
0.6482 Remote Similarity NPD1307 Phase 2
0.6482 Remote Similarity NPD1309 Phase 2
0.6481 Remote Similarity NPD6779 Approved
0.6481 Remote Similarity NPD6782 Approved
0.6481 Remote Similarity NPD6778 Approved
0.6481 Remote Similarity NPD6781 Approved
0.6481 Remote Similarity NPD6780 Approved
0.6481 Remote Similarity NPD6776 Approved
0.6481 Remote Similarity NPD6777 Approved
0.6479 Remote Similarity NPD4413 Clinical (unspecified phase)
0.6477 Remote Similarity NPD3647 Clinical (unspecified phase)
0.6474 Remote Similarity NPD4628 Phase 3
0.6473 Remote Similarity NPD7190 Clinical (unspecified phase)
0.6468 Remote Similarity NPD8127 Discontinued
0.6468 Remote Similarity NPD6107 Approved
0.6462 Remote Similarity NPD3455 Phase 2
0.6462 Remote Similarity NPD3819 Phase 2

Structure

External Identifiers

PubChem CID   5284595
ChEMBL   CHEMBL415284
ZINC  

Physicochemical Properties

Molecular Weight:  311.15
ALogP:  0.3623
MLogP:  3.11
XLogP:  0.727
# Rotatable Bonds:  4
Polar Surface Area:  52.93
# H-Bond Aceptor:  4
# H-Bond Donor:  2
# Rings:  5
# Heavy Atoms:  23

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Biological Activities  
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