Natural Product: NPC267414

Natural Product ID:  NPC267414
Common Name:   Alangiside
IUPAC Name:  
Synonyms:   Alangiside
Molecular Formula:   C25H31NO10
Standard InCHIKey:  BCYNGTTVQNJTCV-MDXCLUIBSA-N
Standard InCHI:  InChI=1S/C25H31NO10/c1-3-12-14-7-16-13-8-17(28)18(33-2)6-11(13)4-5-26(16)23(32)15(14)10-34-24(12)36-25-22(31)21(30)20(29)19(9-27)35-25/h3,6,8,10,12,14,16,19-22,24-25,27-31H,1,4-5,7,9H2,2H3/t12-,14+,16-,19-,20-,21+,22-,24+,25+/m1/s1
Canonical SMILES:  C=C[C@H]1[C@@H](OC=C2[C@H]1C[C@H]1N(C2=O)CCc2c1cc(O)c(c2)OC)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)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
NPO26637.1 Mentha aquatica var. citrata Varieties Lamiaceae Eukaryota UNPD*
NPO24646 Coryphantha elephantidens Species Cactaceae Eukaryota UNPD*
NPO108 Alangium javanicum Species Cornaceae Eukaryota PMID[16124751]
NPO2449 Alangium grisolleoides Species Cornaceae Eukaryota PMID[16124751]
NPO23623 Hirsutella nivea Species Ophiocordycipitaceae Eukaryota UNPD*
NPO22548 Osteospermum jucundum Species Asteraceae Eukaryota UNPD*
NPO24728 Tragopogon porrifolius Species Asteraceae Eukaryota UNPD*
NPO25360 Helminthosporium ravenelii Species Massarinaceae Eukaryota UNPD*
NPO5056 Helichrysum heterolasium Species Asteraceae Eukaryota UNPD*
NPO25409 Ascochyta caulina Species Didymellaceae Eukaryota UNPD*
NPO2719 Amauroascus aureus Species Onygenaceae Eukaryota UNPD*
NPO24211 Parmelia cetrarioides Species Parmeliaceae Eukaryota UNPD*
NPO23138 Swainsona salsula Species Fabaceae Eukaryota UNPD*
NPO18432 Poria corticola Species Coccinellidae Eukaryota UNPD*
NPO24521 Helichrysum revolutum Species Asteraceae Eukaryota UNPD*
NPO24880 Bacterial str NA NA NA UNPD*
NPO25098 Spinacia glabra Species Chenopodiaceae Eukaryota UNPD*
NPO2690 Carapichea ipecacuanha Species Rubiaceae Eukaryota UNPD*
NPO21010 Streptomyces avidinii Species Streptomycetaceae Bacteria UNPD*
NPO26128 Clonostachys rosea Species Bionectriaceae Eukaryota UNPD*
NPO24848 Acodontaster conspicuus Species Odontasteridae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Activity = 3 % 16124751
NPT2 Others Unspecified Activity = 42 % 16124751
NPT2 Others Unspecified Activity = 30 % 16124751
NPT2 Others Unspecified Activity = 25 % 16124751
NPT2 Others Unspecified Activity = 18 % 16124751
NPT2 Others Unspecified Activity = 14 % 16124751

  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 NPC267414 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
0.8325 Intermediate Similarity NPC24228
0.8207 Intermediate Similarity NPC49353
0.8148 Intermediate Similarity NPC230098
0.8083 Intermediate Similarity NPC33256
0.8075 Intermediate Similarity NPC32154
0.8075 Intermediate Similarity NPC474745
0.8054 Intermediate Similarity NPC2314
0.8042 Intermediate Similarity NPC475981
0.8042 Intermediate Similarity NPC474746
0.8021 Intermediate Similarity NPC474325
0.801 Intermediate Similarity NPC475654
0.8 Intermediate Similarity NPC111485
0.8 Intermediate Similarity NPC82056
0.7968 Intermediate Similarity NPC237044
0.7968 Intermediate Similarity NPC241704
0.7958 Intermediate Similarity NPC477259
0.7958 Intermediate Similarity NPC162694
0.7958 Intermediate Similarity NPC169387
0.7935 Intermediate Similarity NPC100566
0.7923 Intermediate Similarity NPC232514
0.7923 Intermediate Similarity NPC238530
0.7923 Intermediate Similarity NPC276944
0.7914 Intermediate Similarity NPC304675
0.7902 Intermediate Similarity NPC38964
0.7857 Intermediate Similarity NPC135006
0.7838 Intermediate Similarity NPC190332
0.7838 Intermediate Similarity NPC181653
0.7824 Intermediate Similarity NPC208890
0.7821 Intermediate Similarity NPC270811
0.7821 Intermediate Similarity NPC471073
0.7819 Intermediate Similarity NPC187678
0.7817 Intermediate Similarity NPC50548
0.7809 Intermediate Similarity NPC151895
0.7809 Intermediate Similarity NPC88249
0.7809 Intermediate Similarity NPC220858
0.7809 Intermediate Similarity NPC192768
0.7809 Intermediate Similarity NPC97221
0.7807 Intermediate Similarity NPC477640
0.7807 Intermediate Similarity NPC470739
0.7807 Intermediate Similarity NPC225597
0.7806 Intermediate Similarity NPC477258
0.7801 Intermediate Similarity NPC116284
0.7784 Intermediate Similarity NPC264850
0.7784 Intermediate Similarity NPC13916
0.7783 Intermediate Similarity NPC248903
0.7778 Intermediate Similarity NPC474470
0.7778 Intermediate Similarity NPC222524
0.7772 Intermediate Similarity NPC59567
0.7766 Intermediate Similarity NPC144314
0.7762 Intermediate Similarity NPC148124
0.776 Intermediate Similarity NPC205167
0.776 Intermediate Similarity NPC249274
0.776 Intermediate Similarity NPC4304
0.7754 Intermediate Similarity NPC109925
0.7754 Intermediate Similarity NPC474475
0.7754 Intermediate Similarity NPC474708
0.7744 Intermediate Similarity NPC475754
0.7744 Intermediate Similarity NPC226708
0.7739 Intermediate Similarity NPC242728
0.7737 Intermediate Similarity NPC320223
0.7737 Intermediate Similarity NPC114364
0.7736 Intermediate Similarity NPC26928
0.7735 Intermediate Similarity NPC184026
0.7735 Intermediate Similarity NPC110416
0.7735 Intermediate Similarity NPC54379
0.7735 Intermediate Similarity NPC172765
0.7735 Intermediate Similarity NPC207757
0.7735 Intermediate Similarity NPC295691
0.7735 Intermediate Similarity NPC469817
0.7735 Intermediate Similarity NPC2413
0.7735 Intermediate Similarity NPC39701
0.7735 Intermediate Similarity NPC193949
0.7735 Intermediate Similarity NPC278799
0.7735 Intermediate Similarity NPC189266
0.7735 Intermediate Similarity NPC5238
0.7735 Intermediate Similarity NPC249797
0.7735 Intermediate Similarity NPC204828
0.7735 Intermediate Similarity NPC127674
0.7735 Intermediate Similarity NPC276588
0.773 Intermediate Similarity NPC231198
0.773 Intermediate Similarity NPC24465
0.7727 Intermediate Similarity NPC46744
0.7727 Intermediate Similarity NPC14622
0.7727 Intermediate Similarity NPC70290
0.7727 Intermediate Similarity NPC73020
0.7727 Intermediate Similarity NPC215098
0.7727 Intermediate Similarity NPC124302
0.7723 Intermediate Similarity NPC80472
0.7716 Intermediate Similarity NPC149962
0.7714 Intermediate Similarity NPC99724
0.7708 Intermediate Similarity NPC102760
0.7704 Intermediate Similarity NPC24260
0.7701 Intermediate Similarity NPC475845
0.7701 Intermediate Similarity NPC290759
0.7701 Intermediate Similarity NPC266176
0.7701 Intermediate Similarity NPC158148
0.7701 Intermediate Similarity NPC58766
0.7701 Intermediate Similarity NPC475686
0.7701 Intermediate Similarity NPC82533
0.7697 Intermediate Similarity NPC428
0.7697 Intermediate Similarity NPC147390
0.7697 Intermediate Similarity NPC24233
0.7697 Intermediate Similarity NPC476571
0.7697 Intermediate Similarity NPC246587
0.7697 Intermediate Similarity NPC135538
0.7692 Intermediate Similarity NPC82763
0.7676 Intermediate Similarity NPC476569
0.7676 Intermediate Similarity NPC320104
0.7653 Intermediate Similarity NPC473716
0.7653 Intermediate Similarity NPC475597
0.765 Intermediate Similarity NPC226652
0.765 Intermediate Similarity NPC120671
0.765 Intermediate Similarity NPC314100
0.765 Intermediate Similarity NPC72788
0.7647 Intermediate Similarity NPC474324
0.7647 Intermediate Similarity NPC57812
0.7644 Intermediate Similarity NPC118633
0.7644 Intermediate Similarity NPC294790
0.7644 Intermediate Similarity NPC148693
0.764 Intermediate Similarity NPC179825
0.764 Intermediate Similarity NPC191376
0.764 Intermediate Similarity NPC321505
0.7634 Intermediate Similarity NPC4138
0.7634 Intermediate Similarity NPC284183
0.7634 Intermediate Similarity NPC121275
0.7632 Intermediate Similarity NPC128560
0.7632 Intermediate Similarity NPC199465
0.7632 Intermediate Similarity NPC229166
0.7617 Intermediate Similarity NPC248642
0.7617 Intermediate Similarity NPC30779
0.7614 Intermediate Similarity NPC94499
0.7609 Intermediate Similarity NPC59028
0.7609 Intermediate Similarity NPC92191
0.7609 Intermediate Similarity NPC106786
0.7604 Intermediate Similarity NPC27887
0.76 Intermediate Similarity NPC123859
0.76 Intermediate Similarity NPC207239
0.7596 Intermediate Similarity NPC147091
0.7596 Intermediate Similarity NPC146288
0.7594 Intermediate Similarity NPC268503
0.7594 Intermediate Similarity NPC240841
0.7594 Intermediate Similarity NPC317272
0.7594 Intermediate Similarity NPC250846
0.7594 Intermediate Similarity NPC42549
0.7594 Intermediate Similarity NPC256012
0.7592 Intermediate Similarity NPC35680
0.7577 Intermediate Similarity NPC156576
0.7577 Intermediate Similarity NPC274716
0.7577 Intermediate Similarity NPC167116
0.7577 Intermediate Similarity NPC254441
0.7576 Intermediate Similarity NPC469816
0.7576 Intermediate Similarity NPC469815
0.7574 Intermediate Similarity NPC2173
0.7574 Intermediate Similarity NPC119818
0.7574 Intermediate Similarity NPC202771
0.7574 Intermediate Similarity NPC328700
0.7568 Intermediate Similarity NPC215829
0.7568 Intermediate Similarity NPC97072
0.7566 Intermediate Similarity NPC311991
0.7565 Intermediate Similarity NPC286119
0.7565 Intermediate Similarity NPC298339
0.7553 Intermediate Similarity NPC474931
0.7553 Intermediate Similarity NPC306555
0.7553 Intermediate Similarity NPC117188
0.7553 Intermediate Similarity NPC205421
0.7553 Intermediate Similarity NPC12053
0.7553 Intermediate Similarity NPC145832
0.7553 Intermediate Similarity NPC252960
0.7553 Intermediate Similarity NPC81218
0.7553 Intermediate Similarity NPC158376
0.7552 Intermediate Similarity NPC15919
0.7551 Intermediate Similarity NPC237579
0.7551 Intermediate Similarity NPC141440
0.7547 Intermediate Similarity NPC44040
0.7541 Intermediate Similarity NPC138487
0.7541 Intermediate Similarity NPC216459
0.7541 Intermediate Similarity NPC41178
0.754 Intermediate Similarity NPC169743
0.7538 Intermediate Similarity NPC470646
0.7528 Intermediate Similarity NPC185838
0.7527 Intermediate Similarity NPC210148
0.7527 Intermediate Similarity NPC133011
0.7527 Intermediate Similarity NPC233029
0.7527 Intermediate Similarity NPC82285
0.7527 Intermediate Similarity NPC37272
0.7526 Intermediate Similarity NPC8836
0.7526 Intermediate Similarity NPC222661
0.7526 Intermediate Similarity NPC49075
0.7526 Intermediate Similarity NPC217748
0.7526 Intermediate Similarity NPC182052
0.7526 Intermediate Similarity NPC258657
0.7526 Intermediate Similarity NPC290005
0.7526 Intermediate Similarity NPC15414
0.7526 Intermediate Similarity NPC42663
0.7526 Intermediate Similarity NPC285931
0.7526 Intermediate Similarity NPC181796
0.7526 Intermediate Similarity NPC229234
0.7526 Intermediate Similarity NPC229373
0.7526 Intermediate Similarity NPC328155
0.7526 Intermediate Similarity NPC7715

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC267414 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
0.8054 Intermediate Similarity NPD5312 Approved
0.8054 Intermediate Similarity NPD5313 Approved
0.7897 Intermediate Similarity NPD7667 Clinical (unspecified phase)
0.7753 Intermediate Similarity NPD3640 Phase 3
0.7753 Intermediate Similarity NPD3641 Approved
0.7753 Intermediate Similarity NPD3639 Approved
0.7727 Intermediate Similarity NPD4420 Approved
0.7725 Intermediate Similarity NPD5619 Clinical (unspecified phase)
0.7602 Intermediate Similarity NPD2490 Approved
0.7602 Intermediate Similarity NPD2488 Approved
0.7582 Intermediate Similarity NPD4772 Phase 2
0.7582 Intermediate Similarity NPD4773 Phase 2
0.7574 Intermediate Similarity NPD5006 Approved
0.7574 Intermediate Similarity NPD5005 Approved
0.7565 Intermediate Similarity NPD3534 Clinical (unspecified phase)
0.7526 Intermediate Similarity NPD8054 Approved
0.7526 Intermediate Similarity NPD6853 Approved
0.7526 Intermediate Similarity NPD6851 Approved
0.7526 Intermediate Similarity NPD8053 Approved
0.7525 Intermediate Similarity NPD2493 Approved
0.7525 Intermediate Similarity NPD3452 Approved
0.7525 Intermediate Similarity NPD2494 Approved
0.7525 Intermediate Similarity NPD3450 Approved
0.7513 Intermediate Similarity NPD7132 Clinical (unspecified phase)
0.7512 Intermediate Similarity NPD7237 Clinical (unspecified phase)
0.7512 Intermediate Similarity NPD6997 Phase 2
0.75 Intermediate Similarity NPD4582 Approved
0.75 Intermediate Similarity NPD4583 Approved
0.75 Intermediate Similarity NPD6297 Approved
0.7474 Intermediate Similarity NPD7281 Phase 3
0.7474 Intermediate Similarity NPD7280 Phase 3
0.7473 Intermediate Similarity NPD824 Approved
0.7451 Intermediate Similarity NPD4002 Approved
0.7451 Intermediate Similarity NPD4004 Approved
0.7447 Intermediate Similarity NPD6107 Approved
0.7411 Intermediate Similarity NPD7291 Discontinued
0.7387 Intermediate Similarity NPD7296 Approved
0.7348 Intermediate Similarity NPD4584 Approved
0.7347 Intermediate Similarity NPD6618 Phase 2
0.7347 Intermediate Similarity NPD7090 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD1337 Clinical (unspecified phase)
0.733 Intermediate Similarity NPD2898 Approved
0.733 Intermediate Similarity NPD27 Approved
0.733 Intermediate Similarity NPD2489 Approved
0.7327 Intermediate Similarity NPD2975 Approved
0.7327 Intermediate Similarity NPD2974 Approved
0.7327 Intermediate Similarity NPD2973 Approved
0.7317 Intermediate Similarity NPD2491 Approved
0.7317 Intermediate Similarity NPD3057 Approved
0.7317 Intermediate Similarity NPD3448 Approved
0.7316 Intermediate Similarity NPD4166 Phase 2
0.7312 Intermediate Similarity NPD6818 Clinical (unspecified phase)
0.7304 Intermediate Similarity NPD4580 Approved
0.7303 Intermediate Similarity NPD4664 Clinical (unspecified phase)
0.7296 Intermediate Similarity NPD7311 Approved
0.7296 Intermediate Similarity NPD2971 Approved
0.7296 Intermediate Similarity NPD7313 Approved
0.7296 Intermediate Similarity NPD2968 Approved
0.7296 Intermediate Similarity NPD7310 Approved
0.7296 Intermediate Similarity NPD7312 Approved
0.7286 Intermediate Similarity NPD5676 Approved
0.7286 Intermediate Similarity NPD6377 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD2970 Approved
0.7277 Intermediate Similarity NPD2969 Approved
0.7265 Intermediate Similarity NPD7048 Phase 3
0.726 Intermediate Similarity NPD7584 Approved
0.7259 Intermediate Similarity NPD7309 Approved
0.7258 Intermediate Similarity NPD7298 Approved
0.725 Intermediate Similarity NPD3808 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD5525 Clinical (unspecified phase)
0.7236 Intermediate Similarity NPD7906 Approved
0.7233 Intermediate Similarity NPD3533 Approved
0.7233 Intermediate Similarity NPD2972 Approved
0.723 Intermediate Similarity NPD7047 Phase 3
0.7225 Intermediate Similarity NPD6071 Discontinued
0.7225 Intermediate Similarity NPD3051 Approved
0.722 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7219 Intermediate Similarity NPD2978 Approved
0.7219 Intermediate Similarity NPD2977 Approved
0.7216 Intermediate Similarity NPD8156 Discontinued
0.7204 Intermediate Similarity NPD7110 Phase 1
0.7204 Intermediate Similarity NPD7109 Clinical (unspecified phase)
0.7186 Intermediate Similarity NPD4663 Approved
0.7181 Intermediate Similarity NPD2560 Approved
0.7181 Intermediate Similarity NPD2563 Approved
0.7165 Intermediate Similarity NPD8252 Approved
0.7165 Intermediate Similarity NPD8251 Approved
0.7165 Intermediate Similarity NPD8099 Discontinued
0.7165 Intermediate Similarity NPD7228 Approved
0.7158 Intermediate Similarity NPD1754 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7907 Approved
0.7143 Intermediate Similarity NPD7701 Phase 2
0.7143 Intermediate Similarity NPD7585 Approved
0.713 Intermediate Similarity NPD4665 Approved
0.713 Intermediate Similarity NPD4111 Phase 1
0.7129 Intermediate Similarity NPD7607 Clinical (unspecified phase)
0.7121 Intermediate Similarity NPD4578 Approved
0.7121 Intermediate Similarity NPD4577 Approved
0.712 Intermediate Similarity NPD2904 Discontinued
0.7112 Intermediate Similarity NPD6385 Approved
0.7112 Intermediate Similarity NPD6386 Approved
0.7095 Intermediate Similarity NPD7583 Approved
0.7092 Intermediate Similarity NPD7074 Phase 3
0.709 Intermediate Similarity NPD5978 Approved
0.709 Intermediate Similarity NPD5977 Approved
0.7089 Intermediate Similarity NPD7827 Phase 1
0.7087 Intermediate Similarity NPD7810 Phase 3
0.7087 Intermediate Similarity NPD7811 Phase 3
0.7081 Intermediate Similarity NPD4040 Phase 1
0.7062 Intermediate Similarity NPD4481 Phase 3
0.7053 Intermediate Similarity NPD4107 Approved
0.7047 Intermediate Similarity NPD4010 Discontinued
0.7041 Intermediate Similarity NPD7054 Approved
0.7026 Intermediate Similarity NPD8153 Approved
0.7026 Intermediate Similarity NPD8152 Approved
0.701 Intermediate Similarity NPD5242 Approved
0.7005 Intermediate Similarity NPD7472 Approved
0.6995 Remote Similarity NPD5241 Discontinued
0.6989 Remote Similarity NPD6662 Clinical (unspecified phase)
0.6986 Remote Similarity NPD8155 Clinical (unspecified phase)
0.698 Remote Similarity NPD6842 Approved
0.698 Remote Similarity NPD6841 Approved
0.698 Remote Similarity NPD6843 Phase 3
0.6971 Remote Similarity NPD5457 Discontinued
0.6968 Remote Similarity NPD6875 Approved
0.6968 Remote Similarity NPD6876 Approved
0.6946 Remote Similarity NPD7235 Clinical (unspecified phase)
0.6942 Remote Similarity NPD5582 Discontinued
0.6938 Remote Similarity NPD4482 Phase 3
0.6935 Remote Similarity NPD7685 Pre-registration
0.6935 Remote Similarity NPD7038 Approved
0.6935 Remote Similarity NPD7039 Approved
0.6931 Remote Similarity NPD3863 Clinical (unspecified phase)
0.6927 Remote Similarity NPD2492 Phase 1
0.6927 Remote Similarity NPD7833 Phase 2
0.6927 Remote Similarity NPD7831 Phase 2
0.6927 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6919 Remote Similarity NPD8320 Phase 1
0.6919 Remote Similarity NPD8319 Approved
0.6908 Remote Similarity NPD5564 Approved
0.6906 Remote Similarity NPD8058 Clinical (unspecified phase)
0.6906 Remote Similarity NPD8059 Phase 3
0.69 Remote Similarity NPD7549 Discontinued
0.6898 Remote Similarity NPD2122 Discontinued
0.6891 Remote Similarity NPD6234 Discontinued
0.6884 Remote Similarity NPD6797 Phase 2
0.6872 Remote Similarity NPD7497 Discontinued
0.6868 Remote Similarity NPD7266 Discontinued
0.6865 Remote Similarity NPD6783 Clinical (unspecified phase)
0.6856 Remote Similarity NPD7201 Clinical (unspecified phase)
0.685 Remote Similarity NPD5192 Clinical (unspecified phase)
0.685 Remote Similarity NPD7251 Discontinued
0.6828 Remote Similarity NPD3124 Discontinued
0.6828 Remote Similarity NPD6723 Discontinued
0.6825 Remote Similarity NPD4017 Approved
0.6818 Remote Similarity NPD3818 Discontinued
0.6818 Remote Similarity NPD7177 Discontinued
0.6818 Remote Similarity NPD8318 Clinical (unspecified phase)
0.6816 Remote Similarity NPD7808 Phase 3
0.681 Remote Similarity NPD6777 Approved
0.681 Remote Similarity NPD6781 Approved
0.681 Remote Similarity NPD6782 Approved
0.681 Remote Similarity NPD6779 Approved
0.681 Remote Similarity NPD6778 Approved
0.681 Remote Similarity NPD6776 Approved
0.681 Remote Similarity NPD6780 Approved
0.6809 Remote Similarity NPD6030 Approved
0.6809 Remote Similarity NPD1670 Discontinued
0.6809 Remote Similarity NPD6031 Approved
0.6806 Remote Similarity NPD37 Approved
0.6806 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6806 Remote Similarity NPD7783 Phase 2
0.6802 Remote Similarity NPD3451 Clinical (unspecified phase)
0.6794 Remote Similarity NPD5071 Phase 2
0.6793 Remote Similarity NPD5177 Phase 3
0.6791 Remote Similarity NPD8389 Clinical (unspecified phase)
0.6788 Remote Similarity NPD4965 Approved
0.6788 Remote Similarity NPD4967 Phase 2
0.6788 Remote Similarity NPD4966 Approved
0.6772 Remote Similarity NPD3686 Approved
0.6772 Remote Similarity NPD4210 Discontinued
0.6772 Remote Similarity NPD3687 Approved
0.6771 Remote Similarity NPD5772 Approved
0.6771 Remote Similarity NPD5773 Approved
0.6766 Remote Similarity NPD7240 Approved
0.6758 Remote Similarity NPD6029 Clinical (unspecified phase)
0.6758 Remote Similarity NPD6028 Clinical (unspecified phase)
0.6754 Remote Similarity NPD6625 Approved
0.6753 Remote Similarity NPD5604 Discontinued
0.6753 Remote Similarity NPD1309 Phase 2
0.6753 Remote Similarity NPD1307 Phase 2
0.6751 Remote Similarity NPD2388 Discontinued
0.675 Remote Similarity NPD5441 Clinical (unspecified phase)
0.6744 Remote Similarity NPD4859 Phase 1
0.6736 Remote Similarity NPD5353 Approved
0.6733 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6731 Remote Similarity NPD4413 Clinical (unspecified phase)
0.6731 Remote Similarity NPD3473 Clinical (unspecified phase)
0.6729 Remote Similarity NPD7999 Approved
0.672 Remote Similarity NPD5307 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   442161
ChEMBL   CHEMBL486383
ZINC  

Physicochemical Properties

Molecular Weight:  505.19
ALogP:  -2.7853
MLogP:  3
XLogP:  -0.1
# Rotatable Bonds:  11
Polar Surface Area:  158.38
# H-Bond Aceptor:  9
# H-Bond Donor:  5
# Rings:  5
# Heavy Atoms:  36

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
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