Natural Product: NPC174758

Natural Product ID:  NPC174758
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C15H10N2O2
Standard InCHIKey:  OWCRARVHWCCRAG-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C15H10N2O2/c1-19-9-2-3-10-11-6-7-16-12-4-5-14(18)17(15(11)12)13(10)8-9/h2-8H,1H3
Canonical SMILES:  COc1ccc2c(c1)n1c(=O)ccc3c1c2ccn3
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
NPO13604 Dermocybe cardinalis Species Cortinariaceae Eukaryota UNPD*
NPO9965 Eurycoma longifolia Species Simaroubaceae Eukaryota UNPD*
NPO3576 Bersama swinnyi Species Melianthaceae Eukaryota UNPD*
NPO9024 Aralidium pinnatifidum Species Torricelliaceae Eukaryota UNPD*
NPO893 Helichrysum sutherlandii Species Asteraceae Eukaryota UNPD*
NPO8220 Russula sardonia Species Russulaceae Eukaryota UNPD*
NPO8640 Nemuaron humboldtii Species Atherospermataceae Eukaryota UNPD*
NPO3924 Penicillium alutaceum Species Aspergillaceae Eukaryota UNPD*
NPO9375 Medium grandiflorum NA NA NA UNPD*
NPO2084 Acinetobacter calcoaceticus Species Moraxellaceae Bacteria UNPD*
NPO13494 Prosopis kuntzei Species Fabaceae Eukaryota UNPD*
NPO11530 Heterosigma akashiwo Species Chattonellaceae Eukaryota UNPD*
NPO13798 Cheilanthes marantae Species Pteridaceae Eukaryota UNPD*
NPO6014 Goniothalamus undulatus Species Annonaceae Eukaryota UNPD*
NPO11072 Geigeria schinzii Species Asteraceae Eukaryota UNPD*
NPO20383 Stenocereus thurberi Species Cactaceae Eukaryota UNPD*
NPO14602 Vitex negundo Species Lamiaceae Eukaryota UNPD*
NPO12890 Ophryosporus charua Species Asteraceae Eukaryota UNPD*
NPO13692 Leontice kiangnanensis Species Berberidaceae Eukaryota UNPD*
NPO9644 Euphorbia resinifera Species Euphorbiaceae Eukaryota UNPD*
NPO8820 Lophocereus marginatus Species Cactaceae Eukaryota UNPD*
NPO5401 Monanchora unguiculata Species Crambeidae Eukaryota UNPD*
NPO22888 Lophiostoma vaginatispora Species Lophiostomataceae Eukaryota UNPD*
NPO1418 Boletinus paluster Species Gyrodontaceae Eukaryota UNPD*
NPO20931 Simaba multiflora Species Simaroubaceae Eukaryota xylem DOI[10.1016/S0040-4039(00)86970-1]
NPO6859 Eurycoma harmandiana Species Simaroubaceae Eukaryota TCMID*
NPO28351 Simaba cuspidata Species Simaroubaceae Eukaryota bark DOI[10.1016/S0031-9422(00)81981-0]
NPO9965 Eurycoma longifolia Species Simaroubaceae Eukaryota TCMID*
NPO9965 Eurycoma longifolia Species Simaroubaceae Eukaryota Root PMID[1800638]
NPO14280 Helichrysum angustifolium Species Asteraceae Eukaryota UNPD*
NPO12988 Blainvillea latifolia Species Asteraceae Eukaryota UNPD*
NPO12026 Papaver radicatum Species Papaveraceae Eukaryota UNPD*
NPO20318 Acinetobacter baumannii Species Moraxellaceae Bacteria UNPD*
NPO12577 Pinus glauca Species Pinaceae Eukaryota UNPD*
NPO2505 Pachycereus pringlei Species Cactaceae Eukaryota UNPD*
NPO6626 Pteris spinulosa Species Pteridaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT91 Cell Line KB Homo sapiens ED5 = 2.1 ug/ml 1800638
NPT2 Others Unspecified ED5 > 20 ug/ml 1800638
NPT2 Others Unspecified ED5 = 3.5 ug/ml 1800638
NPT2 Others Unspecified ED5 = 4.5 ug/ml 1800638
NPT2 Others Unspecified ED5 = 4 ug/ml 1800638
NPT2 Others Unspecified ED5 = 2.5 ug/ml 1800638
NPT2 Others Unspecified ED5 = 4.2 ug/ml 1800638
NPT168 Cell Line P388 Mus musculus ED50 = 1.4 ug/ml 1800638
NPT81 Cell Line A549 Homo sapiens ED50 < 2.5 ug/ml 14575431
NPT81 Cell Line A549 Homo sapiens Inhibition = 55 % 14575431
NPT83 Cell Line MCF7 Homo sapiens ED50 = 4.5 ug/ml 14575431
NPT2 Others Unspecified IC50 = 7400 nM 24467387
NPT2 Others Unspecified Inhibition > 50 % 24467387
NPT178 Individual Protein Protein-tyrosine phosphatase 1B Homo sapiens Inhibition = 34.9 % 25819098

  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 NPC174758 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
0.9686 High Similarity NPC274982
0.9681 High Similarity NPC174672
0.9421 High Similarity NPC82548
0.9219 High Similarity NPC287208
0.9211 High Similarity NPC53144
0.8929 High Similarity NPC85273
0.8912 High Similarity NPC200836
0.8906 High Similarity NPC232727
0.886 High Similarity NPC295898
0.8836 High Similarity NPC198673
0.8667 High Similarity NPC211813
0.8653 High Similarity NPC239954
0.8653 High Similarity NPC168911
0.8643 High Similarity NPC167860
0.8643 High Similarity NPC123976
0.8638 High Similarity NPC99891
0.8579 High Similarity NPC285558
0.8502 High Similarity NPC122436
0.841 Intermediate Similarity NPC267928
0.8406 Intermediate Similarity NPC60621
0.8398 Intermediate Similarity NPC193267
0.8398 Intermediate Similarity NPC213530
0.8376 Intermediate Similarity NPC176538
0.8367 Intermediate Similarity NPC212213
0.8309 Intermediate Similarity NPC17565
0.8284 Intermediate Similarity NPC264176
0.8263 Intermediate Similarity NPC260434
0.8241 Intermediate Similarity NPC235685
0.8203 Intermediate Similarity NPC101350
0.8191 Intermediate Similarity NPC19872
0.8186 Intermediate Similarity NPC141053
0.8159 Intermediate Similarity NPC245816
0.8159 Intermediate Similarity NPC476138
0.8152 Intermediate Similarity NPC65277
0.8125 Intermediate Similarity NPC84478
0.8084 Intermediate Similarity NPC471762
0.8057 Intermediate Similarity NPC310118
0.8049 Intermediate Similarity NPC185782
0.801 Intermediate Similarity NPC315957
0.801 Intermediate Similarity NPC12649
0.7981 Intermediate Similarity NPC476287
0.7961 Intermediate Similarity NPC469589
0.7956 Intermediate Similarity NPC26543
0.7955 Intermediate Similarity NPC30540
0.7952 Intermediate Similarity NPC305984
0.7933 Intermediate Similarity NPC26679
0.7921 Intermediate Similarity NPC234197
0.7921 Intermediate Similarity NPC121772
0.7917 Intermediate Similarity NPC66777
0.79 Intermediate Similarity NPC13880
0.7892 Intermediate Similarity NPC293487
0.7871 Intermediate Similarity NPC287437
0.787 Intermediate Similarity NPC110151
0.7861 Intermediate Similarity NPC478182
0.7857 Intermediate Similarity NPC472434
0.7854 Intermediate Similarity NPC16452
0.7854 Intermediate Similarity NPC476581
0.7854 Intermediate Similarity NPC36229
0.784 Intermediate Similarity NPC128115
0.7837 Intermediate Similarity NPC470020
0.7834 Intermediate Similarity NPC314954
0.7833 Intermediate Similarity NPC329747
0.7833 Intermediate Similarity NPC477019
0.7832 Intermediate Similarity NPC63971
0.7832 Intermediate Similarity NPC91868
0.783 Intermediate Similarity NPC303658
0.782 Intermediate Similarity NPC470799
0.782 Intermediate Similarity NPC170114
0.782 Intermediate Similarity NPC8022
0.7805 Intermediate Similarity NPC475774
0.7789 Intermediate Similarity NPC476518
0.7789 Intermediate Similarity NPC92111
0.7784 Intermediate Similarity NPC24864
0.7783 Intermediate Similarity NPC476582
0.7783 Intermediate Similarity NPC4071
0.7783 Intermediate Similarity NPC476578
0.7778 Intermediate Similarity NPC296527
0.7773 Intermediate Similarity NPC470549
0.7762 Intermediate Similarity NPC53069
0.7762 Intermediate Similarity NPC202768
0.7762 Intermediate Similarity NPC296482
0.775 Intermediate Similarity NPC195268
0.775 Intermediate Similarity NPC133140
0.7749 Intermediate Similarity NPC14651
0.7749 Intermediate Similarity NPC121658
0.7739 Intermediate Similarity NPC76748
0.7738 Intermediate Similarity NPC253675
0.7729 Intermediate Similarity NPC323345
0.7729 Intermediate Similarity NPC470164
0.7725 Intermediate Similarity NPC162530
0.7718 Intermediate Similarity NPC223427
0.7713 Intermediate Similarity NPC478185
0.7713 Intermediate Similarity NPC177404
0.7711 Intermediate Similarity NPC307963
0.7707 Intermediate Similarity NPC31930
0.77 Intermediate Similarity NPC473513
0.7696 Intermediate Similarity NPC81535
0.7696 Intermediate Similarity NPC21638
0.7696 Intermediate Similarity NPC32534
0.7692 Intermediate Similarity NPC313189
0.7684 Intermediate Similarity NPC478183
0.7678 Intermediate Similarity NPC171409
0.7678 Intermediate Similarity NPC96405
0.7674 Intermediate Similarity NPC323969
0.7672 Intermediate Similarity NPC478184
0.7671 Intermediate Similarity NPC194740
0.7667 Intermediate Similarity NPC11464
0.7665 Intermediate Similarity NPC284678
0.7664 Intermediate Similarity NPC173080
0.7662 Intermediate Similarity NPC472435
0.7662 Intermediate Similarity NPC324149
0.7656 Intermediate Similarity NPC475910
0.7653 Intermediate Similarity NPC148183
0.7653 Intermediate Similarity NPC152768
0.7647 Intermediate Similarity NPC26850
0.7647 Intermediate Similarity NPC469554
0.7644 Intermediate Similarity NPC472111
0.7644 Intermediate Similarity NPC238457
0.7642 Intermediate Similarity NPC471080
0.7642 Intermediate Similarity NPC469592
0.7638 Intermediate Similarity NPC46580
0.7635 Intermediate Similarity NPC251090
0.763 Intermediate Similarity NPC208284
0.7626 Intermediate Similarity NPC157931
0.7623 Intermediate Similarity NPC295228
0.7617 Intermediate Similarity NPC111624
0.7614 Intermediate Similarity NPC176127
0.7608 Intermediate Similarity NPC135549
0.7604 Intermediate Similarity NPC91895
0.7596 Intermediate Similarity NPC475070
0.7596 Intermediate Similarity NPC470500
0.7594 Intermediate Similarity NPC316981
0.7594 Intermediate Similarity NPC472098
0.7594 Intermediate Similarity NPC202605
0.7594 Intermediate Similarity NPC112206
0.7593 Intermediate Similarity NPC472099
0.7581 Intermediate Similarity NPC26872
0.7569 Intermediate Similarity NPC322482
0.7568 Intermediate Similarity NPC101543
0.7564 Intermediate Similarity NPC472436
0.7561 Intermediate Similarity NPC72211
0.7547 Intermediate Similarity NPC146418
0.7546 Intermediate Similarity NPC292958
0.7524 Intermediate Similarity NPC4687
0.7524 Intermediate Similarity NPC476167
0.7524 Intermediate Similarity NPC249583
0.7511 Intermediate Similarity NPC472061
0.75 Intermediate Similarity NPC100079
0.75 Intermediate Similarity NPC23614
0.75 Intermediate Similarity NPC5145
0.75 Intermediate Similarity NPC470018
0.75 Intermediate Similarity NPC57398
0.75 Intermediate Similarity NPC473041
0.75 Intermediate Similarity NPC290689
0.75 Intermediate Similarity NPC131017
0.75 Intermediate Similarity NPC469594
0.7488 Intermediate Similarity NPC11017
0.7487 Intermediate Similarity NPC62069
0.7478 Intermediate Similarity NPC474183
0.7477 Intermediate Similarity NPC149471
0.7477 Intermediate Similarity NPC236668
0.7477 Intermediate Similarity NPC271215
0.7476 Intermediate Similarity NPC476124
0.7476 Intermediate Similarity NPC192315
0.7476 Intermediate Similarity NPC476121
0.7475 Intermediate Similarity NPC161887
0.7475 Intermediate Similarity NPC219963
0.7475 Intermediate Similarity NPC266551
0.7475 Intermediate Similarity NPC134079
0.7467 Intermediate Similarity NPC477549
0.7466 Intermediate Similarity NPC74575
0.7465 Intermediate Similarity NPC298436
0.7465 Intermediate Similarity NPC46451
0.7463 Intermediate Similarity NPC70259
0.7463 Intermediate Similarity NPC194967
0.7462 Intermediate Similarity NPC72980
0.7452 Intermediate Similarity NPC470586
0.7442 Intermediate Similarity NPC146976
0.7442 Intermediate Similarity NPC235076
0.7441 Intermediate Similarity NPC193238
0.7431 Intermediate Similarity NPC477533
0.743 Intermediate Similarity NPC118940
0.7427 Intermediate Similarity NPC243834
0.7427 Intermediate Similarity NPC224928
0.7427 Intermediate Similarity NPC70956
0.7419 Intermediate Similarity NPC264285
0.7418 Intermediate Similarity NPC188420
0.7415 Intermediate Similarity NPC205934
0.7415 Intermediate Similarity NPC43787
0.7413 Intermediate Similarity NPC204385
0.7412 Intermediate Similarity NPC148889
0.7406 Intermediate Similarity NPC470931
0.7405 Intermediate Similarity NPC478186
0.7398 Intermediate Similarity NPC312872
0.7395 Intermediate Similarity NPC266931
0.7395 Intermediate Similarity NPC234078
0.7395 Intermediate Similarity NPC221100
0.7391 Intermediate Similarity NPC474916
0.7383 Intermediate Similarity NPC87413
0.7382 Intermediate Similarity NPC285635

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC174758 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
0.8119 Intermediate Similarity NPD4795 Phase 2
0.8045 Intermediate Similarity NPD6790 Phase 1
0.801 Intermediate Similarity NPD1739 Approved
0.801 Intermediate Similarity NPD1740 Approved
0.7929 Intermediate Similarity NPD4372 Phase 1
0.7913 Intermediate Similarity NPD5658 Approved
0.7889 Intermediate Similarity NPD1304 Clinical (unspecified phase)
0.7867 Intermediate Similarity NPD7823 Clinical (unspecified phase)
0.7838 Intermediate Similarity NPD2921 Clinical (unspecified phase)
0.7816 Intermediate Similarity NPD5601 Phase 2
0.7762 Intermediate Similarity NPD3816 Phase 1
0.7762 Intermediate Similarity NPD3815 Phase 1
0.7761 Intermediate Similarity NPD4418 Discontinued
0.7757 Intermediate Similarity NPD6242 Discontinued
0.775 Intermediate Similarity NPD3921 Approved
0.775 Intermediate Similarity NPD3924 Approved
0.775 Intermediate Similarity NPD3922 Approved
0.775 Intermediate Similarity NPD3923 Approved
0.7742 Intermediate Similarity NPD7426 Phase 1
0.7716 Intermediate Similarity NPD4889 Approved
0.7711 Intermediate Similarity NPD1038 Approved
0.7673 Intermediate Similarity NPD6861 Clinical (unspecified phase)
0.7662 Intermediate Similarity NPD6569 Phase 2
0.7642 Intermediate Similarity NPD5482 Discontinued
0.7608 Intermediate Similarity NPD7222 Phase 2
0.7606 Intermediate Similarity NPD6140 Clinical (unspecified phase)
0.7596 Intermediate Similarity NPD3397 Phase 2
0.7591 Intermediate Similarity NPD5559 Phase 2
0.7565 Intermediate Similarity NPD1078 Clinical (unspecified phase)
0.7563 Intermediate Similarity NPD3386 Phase 2
0.7563 Intermediate Similarity NPD7414 Clinical (unspecified phase)
0.7554 Intermediate Similarity NPD6961 Discontinued
0.7552 Intermediate Similarity NPD6872 Clinical (unspecified phase)
0.7548 Intermediate Similarity NPD5513 Phase 2
0.7547 Intermediate Similarity NPD6567 Clinical (unspecified phase)
0.7544 Intermediate Similarity NPD5483 Clinical (unspecified phase)
0.7543 Intermediate Similarity NPD4926 Clinical (unspecified phase)
0.7522 Intermediate Similarity NPD4558 Phase 2
0.7489 Intermediate Similarity NPD6525 Clinical (unspecified phase)
0.7477 Intermediate Similarity NPD6969 Phase 2
0.7477 Intermediate Similarity NPD6968 Phase 2
0.7476 Intermediate Similarity NPD5530 Phase 1
0.7475 Intermediate Similarity NPD4203 Approved
0.7475 Intermediate Similarity NPD4204 Approved
0.7465 Intermediate Similarity NPD3763 Approved
0.7455 Intermediate Similarity NPD7558 Phase 2
0.7455 Intermediate Similarity NPD6223 Clinical (unspecified phase)
0.7445 Intermediate Similarity NPD7025 Clinical (unspecified phase)
0.7443 Intermediate Similarity NPD6824 Clinical (unspecified phase)
0.7441 Intermediate Similarity NPD1392 Approved
0.7441 Intermediate Similarity NPD7453 Approved
0.7441 Intermediate Similarity NPD7452 Approved
0.7432 Intermediate Similarity NPD7710 Clinical (unspecified phase)
0.7422 Intermediate Similarity NPD6964 Approved
0.7422 Intermediate Similarity NPD6963 Approved
0.7415 Intermediate Similarity NPD3395 Approved
0.7415 Intermediate Similarity NPD3396 Approved
0.7401 Intermediate Similarity NPD7729 Clinical (unspecified phase)
0.7399 Intermediate Similarity NPD5801 Clinical (unspecified phase)
0.7387 Intermediate Similarity NPD3259 Approved
0.7366 Intermediate Similarity NPD802 Phase 2
0.7357 Intermediate Similarity NPD4958 Clinical (unspecified phase)
0.7356 Intermediate Similarity NPD4118 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD7069 Discontinued
0.7348 Intermediate Similarity NPD7068 Approved
0.7348 Intermediate Similarity NPD7067 Approved
0.7346 Intermediate Similarity NPD4036 Approved
0.7346 Intermediate Similarity NPD4033 Approved
0.7346 Intermediate Similarity NPD4039 Approved
0.7346 Intermediate Similarity NPD4034 Approved
0.7346 Intermediate Similarity NPD31 Approved
0.7346 Intermediate Similarity NPD4037 Approved
0.7346 Intermediate Similarity NPD32 Approved
0.7346 Intermediate Similarity NPD4122 Approved
0.7346 Intermediate Similarity NPD4038 Approved
0.7346 Intermediate Similarity NPD4035 Approved
0.7345 Intermediate Similarity NPD2757 Phase 2
0.7342 Intermediate Similarity NPD7676 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD7674 Phase 3
0.7342 Intermediate Similarity NPD7675 Phase 3
0.733 Intermediate Similarity NPD6306 Phase 2
0.7324 Intermediate Similarity NPD5863 Clinical (unspecified phase)
0.7321 Intermediate Similarity NPD4396 Clinical (unspecified phase)
0.7304 Intermediate Similarity NPD3321 Discontinued
0.7302 Intermediate Similarity NPD3570 Phase 2
0.73 Intermediate Similarity NPD8091 Phase 3
0.7295 Intermediate Similarity NPD3477 Phase 2
0.7295 Intermediate Similarity NPD3478 Clinical (unspecified phase)
0.7291 Intermediate Similarity NPD6257 Clinical (unspecified phase)
0.7291 Intermediate Similarity NPD1033 Clinical (unspecified phase)
0.7291 Intermediate Similarity NPD1034 Phase 3
0.7286 Intermediate Similarity NPD3920 Phase 2
0.7285 Intermediate Similarity NPD1856 Discontinued
0.7282 Intermediate Similarity NPD5575 Clinical (unspecified phase)
0.7281 Intermediate Similarity NPD4897 Phase 2
0.7277 Intermediate Similarity NPD6344 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD7424 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD4548 Discontinued
0.7273 Intermediate Similarity NPD3825 Phase 3
0.7268 Intermediate Similarity NPD2780 Approved
0.7268 Intermediate Similarity NPD2782 Approved
0.7268 Intermediate Similarity NPD2334 Discontinued
0.7261 Intermediate Similarity NPD5450 Discontinued
0.726 Intermediate Similarity NPD4899 Clinical (unspecified phase)
0.726 Intermediate Similarity NPD8405 Clinical (unspecified phase)
0.726 Intermediate Similarity NPD6568 Discontinued
0.726 Intermediate Similarity NPD5948 Phase 2
0.726 Intermediate Similarity NPD1622 Discontinued
0.7257 Intermediate Similarity NPD4885 Approved
0.7257 Intermediate Similarity NPD8049 Phase 2
0.725 Intermediate Similarity NPD2600 Approved
0.725 Intermediate Similarity NPD2601 Approved
0.725 Intermediate Similarity NPD2599 Approved
0.7248 Intermediate Similarity NPD5612 Discontinued
0.7244 Intermediate Similarity NPD4952 Phase 3
0.7244 Intermediate Similarity NPD7589 Clinical (unspecified phase)
0.723 Intermediate Similarity NPD3003 Approved
0.7225 Intermediate Similarity NPD6494 Phase 2
0.7225 Intermediate Similarity NPD5040 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD6172 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD3939 Suspended
0.7217 Intermediate Similarity NPD8017 Clinical (unspecified phase)
0.7217 Intermediate Similarity NPD8016 Phase 3
0.7215 Intermediate Similarity NPD8247 Approved
0.7215 Intermediate Similarity NPD8246 Approved
0.7202 Intermediate Similarity NPD5293 Phase 2
0.7202 Intermediate Similarity NPD3257 Approved
0.7198 Intermediate Similarity NPD4551 Phase 2
0.7195 Intermediate Similarity NPD5930 Phase 3
0.7195 Intermediate Similarity NPD6856 Discontinued
0.7195 Intermediate Similarity NPD8479 Phase 2
0.7194 Intermediate Similarity NPD2781 Approved
0.7182 Intermediate Similarity NPD4429 Discontinued
0.7182 Intermediate Similarity NPD3354 Phase 2
0.7181 Intermediate Similarity NPD7796 Approved
0.7181 Intermediate Similarity NPD7705 Clinical (unspecified phase)
0.7181 Intermediate Similarity NPD7797 Approved
0.7177 Intermediate Similarity NPD7948 Phase 1
0.7176 Intermediate Similarity NPD4900 Clinical (unspecified phase)
0.7167 Intermediate Similarity NPD6230 Discontinued
0.7167 Intermediate Similarity NPD5867 Clinical (unspecified phase)
0.7163 Intermediate Similarity NPD2189 Approved
0.7163 Intermediate Similarity NPD3324 Clinical (unspecified phase)
0.7163 Intermediate Similarity NPD2187 Approved
0.7163 Intermediate Similarity NPD7467 Discontinued
0.7162 Intermediate Similarity NPD4923 Phase 1
0.7162 Intermediate Similarity NPD4881 Clinical (unspecified phase)
0.7157 Intermediate Similarity NPD4375 Approved
0.7156 Intermediate Similarity NPD7268 Clinical (unspecified phase)
0.715 Intermediate Similarity NPD4901 Clinical (unspecified phase)
0.715 Intermediate Similarity NPD1032 Phase 2
0.7149 Intermediate Similarity NPD6741 Clinical (unspecified phase)
0.7149 Intermediate Similarity NPD7194 Discontinued
0.7149 Intermediate Similarity NPD4373 Phase 2
0.7143 Intermediate Similarity NPD5067 Phase 2
0.7143 Intermediate Similarity NPD3938 Phase 1
0.7143 Intermediate Similarity NPD5066 Phase 2
0.7143 Intermediate Similarity NPD4987 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD4858 Phase 2
0.7136 Intermediate Similarity NPD1923 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD6281 Approved
0.713 Intermediate Similarity NPD2285 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD6572 Phase 2
0.7124 Intermediate Similarity NPD7555 Discontinued
0.7124 Intermediate Similarity NPD6573 Phase 3
0.7119 Intermediate Similarity NPD8284 Discontinued
0.7114 Intermediate Similarity NPD1620 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD112 Approved
0.7113 Intermediate Similarity NPD9705 Discontinued
0.7111 Intermediate Similarity NPD7603 Discontinued
0.7109 Intermediate Similarity NPD7000 Clinical (unspecified phase)
0.7109 Intermediate Similarity NPD6999 Discontinued
0.7109 Intermediate Similarity NPD1768 Approved
0.7104 Intermediate Similarity NPD5632 Approved
0.7095 Intermediate Similarity NPD2952 Discontinued
0.7095 Intermediate Similarity NPD6228 Discontinued
0.7093 Intermediate Similarity NPD8512 Phase 3
0.7092 Intermediate Similarity NPD2915 Discontinued
0.7091 Intermediate Similarity NPD2412 Clinical (unspecified phase)
0.7091 Intermediate Similarity NPD7112 Discontinued
0.7085 Intermediate Similarity NPD5506 Approved
0.7085 Intermediate Similarity NPD5507 Approved
0.7083 Intermediate Similarity NPD2916 Discontinued
0.7082 Intermediate Similarity NPD6716 Phase 1
0.7076 Intermediate Similarity NPD4369 Phase 2
0.7072 Intermediate Similarity NPD6500 Approved
0.7072 Intermediate Similarity NPD3258 Approved
0.7072 Intermediate Similarity NPD6501 Approved
0.7067 Intermediate Similarity NPD6246 Approved
0.7065 Intermediate Similarity NPD5751 Clinical (unspecified phase)
0.7064 Intermediate Similarity NPD8100 Phase 3
0.7064 Intermediate Similarity NPD5488 Discontinued
0.7061 Intermediate Similarity NPD6962 Phase 2
0.7059 Intermediate Similarity NPD3326 Clinical (unspecified phase)
0.7059 Intermediate Similarity NPD7859 Phase 2
0.7048 Intermediate Similarity NPD5512 Phase 3
0.7048 Intermediate Similarity NPD6550 Discontinued
0.7045 Intermediate Similarity NPD5902 Approved
0.7045 Intermediate Similarity NPD5903 Approved
0.7025 Intermediate Similarity NPD5116 Phase 1

Structure

External Identifiers

PubChem CID   9881423
ChEMBL   CHEMBL504978
ZINC  

Physicochemical Properties

Molecular Weight:  250.07
ALogP:  -0.3255
MLogP:  2.67
XLogP:  2.154
# Rotatable Bonds:  2
Polar Surface Area:  44.12
# H-Bond Aceptor:  3
# H-Bond Donor:  0
# Rings:  4
# Heavy Atoms:  19

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Biological Activities  
Similar NPs/Drugs