Natural Product: NPC27349

Natural Product ID:  NPC27349
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C20H32O3
Standard InCHIKey:  ACIODAKBJVREKJ-MAPHFDCTSA-N
Standard InCHI:  InChI=1S/C20H32O3/c1-17(12-21)7-3-8-18(2)15(17)6-9-19-10-14(4-5-16(18)19)20(23,11-19)13-22/h12,14-16,22-23H,3-11,13H2,1-2H3/t14-,15-,16+,17+,18-,19+,20+/m1/s1
Canonical SMILES:  OC[C@@]1(O)C[C@@]23C[C@H]1CC[C@H]3[C@]1([C@H](CC2)[C@](C)(C=O)CCC1)C
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
NPO33342 Bruguiera gymnorrhiza Species Rhizophoraceae Eukaryota stems Xiamen, China 2002-JUN PMID[15387677]
NPO11408 Podocarpus amarus Species Podocarpaceae Eukaryota UNPD*
NPO21437 Rhododendron aureum Species Ericaceae Eukaryota UNPD*
NPO15599 Daldinia concentrica Species Xylariaceae Eukaryota UNPD*
NPO13789 Paranephelius uniflorus Species Asteraceae Eukaryota UNPD*
NPO4507 Bruguiera gymnorhiza Species Rhizophoraceae Eukaryota UNPD*
NPO16455 Xylopia aethiopica Species Annonaceae Eukaryota UNPD*
NPO8010 Otostegia fruticosa Species Lamiaceae Eukaryota UNPD*
NPO17921 Allium monspessulanum Species Amaryllidaceae Eukaryota UNPD*
NPO14813 Agaricus silvaticus Species Agaricaceae Eukaryota UNPD*
NPO16052 Chromodoris obsoleta Species Chromodorididae Eukaryota UNPD*
NPO84 Isoberlinia angolensis Species Fabaceae Eukaryota UNPD*
NPO17145 Aegiceras corniculatum Species Primulaceae Eukaryota UNPD*
NPO11760 Teucrium orientale Species Lamiaceae Eukaryota UNPD*
NPO14575 Periploca forrestii Species Cosmopterigidae Eukaryota UNPD*
NPO25550 Buchenavia tetraphylla Species Combretaceae Eukaryota UNPD*
NPO14002 Petalostemon purpureum Species Fabaceae Eukaryota UNPD*
NPO18073 Justicia trinervia Species Acanthaceae Eukaryota UNPD*
NPO17375 Ceramium botryocarpum Species Ceramiaceae Eukaryota UNPD*
NPO16695 Fumaria kraliki Species Papaveraceae Eukaryota UNPD*
NPO16812 Ajuga bracteosa Species Lamiaceae Eukaryota UNPD*
NPO7905 Lepista irina Species Tricholomataceae Eukaryota UNPD*
NPO10770 Ptilota pectinata Species Ceramiaceae Eukaryota UNPD*
NPO15919 Streptomyces caelestis Species Streptomycetaceae Bacteria UNPD*
NPO15004 Artemisia taurica Species Asteraceae Eukaryota UNPD*
NPO2155 Tephroseris integrifolia Species Asteraceae Eukaryota UNPD*
NPO13013 Saccharothrix mutabilis Species Pseudonocardiaceae Bacteria UNPD*
NPO2550 Trichoderma citrinum Species Hypocreaceae Eukaryota UNPD*
NPO28319 Ulva prolifera Species Ulvaceae Eukaryota UNPD*
NPO16215 Umbilicaria cinereorufescens Species Umbilicariaceae Eukaryota UNPD*
NPO17602 Arbutus menziesii Species Ericaceae Eukaryota UNPD*
NPO17844 Agaricus integer Species Agaricaceae Eukaryota UNPD*
NPO17339 Macaranga sinensis Species Euphorbiaceae Eukaryota UNPD*
NPO9951 Hyella caespitosa Species Hyellaceae Bacteria UNPD*
NPO17218 Helichrysum nudifolium Species Asteraceae Eukaryota UNPD*
NPO16456 Mirabilis jalapa Species Nyctaginaceae Eukaryota UNPD*
NPO22097 Plakinastrella clathrata Species Plakinidae Eukaryota UNPD*
NPO17304 Sipunculus nudus Species Sipunculidae Eukaryota UNPD*
NPO16923 Cereus chrysacanthus Species Sagartiidae Eukaryota UNPD*
NPO15748 Hypoxis nyasica Species Hypoxidaceae Eukaryota UNPD*
NPO15545 Veltheimia viridifolia Species Hyacinthaceae Eukaryota UNPD*
NPO28821 Stichopus horrens Species Stichopodidae Eukaryota UNPD*
NPO17071 Coeloseira pacifica Species Champiaceae Eukaryota UNPD*
NPO9189 Streptomyces atratus Species Streptomycetaceae Bacteria UNPD*
NPO16566 Cinnamosma madagascariensis Species Canellaceae Eukaryota UNPD*
NPO28198 Siegesbeckia gummifer Species Asteraceae Eukaryota TCM_Taiwan*
NPO4336 Echiochilon pauciflorum Species Boraginaceae Eukaryota UNPD*
NPO2884 Annona squamosa Species Annonaceae Eukaryota TCM_Taiwan*
NPO17999 Sonneratia alba Species Lythraceae Eukaryota UNPD*
NPO30031 Siegesbeckia pubescens Species Asteraceae Eukaryota TCM_Taiwan*
NPO26788 Sophora viciifolia Species Fabaceae Eukaryota UNPD*
NPO30657 Lndigofera tinctoria NA NA NA TCM_Taiwan*
NPO5119 Pseudomonas chlororaphis Species Pseudomonadaceae Bacteria UNPD*
NPO16329 Potebniamyces gallicola Species Phacidiaceae Eukaryota UNPD*
NPO28868 Pardachirus pavoninus Species Soleidae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Inhibition = 0.5 % 12398544
NPT2 Others Unspecified Inhibition = 4.9 % 12398544
NPT2 Others Unspecified Inhibition = 10.3 % 12398544
NPT2 Others Unspecified Inhibition = 3.2 % 12398544
NPT1460 Cell Line L929 Mus musculus GI50 = 50 ug/ml 15387677
NPT111 Cell Line K562 Homo sapiens GI50 = 50 ug/ml 15387677
NPT165 Cell Line HeLa Homo sapiens CC50 = 50 ug/ml 15387677

  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 NPC27349 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
1.0 High Similarity NPC24014
0.9571 High Similarity NPC472854
0.9178 High Similarity NPC477919
0.9178 High Similarity NPC180199
0.9054 High Similarity NPC199965
0.9054 High Similarity NPC476732
0.8889 High Similarity NPC310766
0.8732 High Similarity NPC324607
0.8732 High Similarity NPC321732
0.8696 High Similarity NPC475943
0.8696 High Similarity NPC190827
0.8696 High Similarity NPC243469
0.8667 High Similarity NPC264602
0.8611 High Similarity NPC476731
0.8592 High Similarity NPC478228
0.859 High Similarity NPC477935
0.859 High Similarity NPC317066
0.8571 High Similarity NPC472853
0.8571 High Similarity NPC470609
0.8493 Intermediate Similarity NPC320549
0.8493 Intermediate Similarity NPC58057
0.8493 Intermediate Similarity NPC151018
0.8493 Intermediate Similarity NPC156277
0.8472 Intermediate Similarity NPC319671
0.8472 Intermediate Similarity NPC469941
0.8472 Intermediate Similarity NPC252032
0.8472 Intermediate Similarity NPC64466
0.8472 Intermediate Similarity NPC476734
0.8462 Intermediate Similarity NPC77311
0.8451 Intermediate Similarity NPC63190
0.8378 Intermediate Similarity NPC232112
0.8356 Intermediate Similarity NPC477929
0.8354 Intermediate Similarity NPC477936
0.8333 Intermediate Similarity NPC473225
0.8267 Intermediate Similarity NPC280026
0.8267 Intermediate Similarity NPC254340
0.8267 Intermediate Similarity NPC167702
0.825 Intermediate Similarity NPC259173
0.8243 Intermediate Similarity NPC473267
0.8228 Intermediate Similarity NPC12933
0.8219 Intermediate Similarity NPC327728
0.8219 Intermediate Similarity NPC6120
0.8219 Intermediate Similarity NPC213178
0.8219 Intermediate Similarity NPC131892
0.8205 Intermediate Similarity NPC31302
0.8205 Intermediate Similarity NPC245029
0.8182 Intermediate Similarity NPC23884
0.8182 Intermediate Similarity NPC475031
0.8182 Intermediate Similarity NPC474404
0.8171 Intermediate Similarity NPC472272
0.8171 Intermediate Similarity NPC476726
0.8171 Intermediate Similarity NPC476727
0.8171 Intermediate Similarity NPC476730
0.8171 Intermediate Similarity NPC474448
0.8158 Intermediate Similarity NPC125767
0.8158 Intermediate Similarity NPC273366
0.8158 Intermediate Similarity NPC97534
0.8158 Intermediate Similarity NPC212733
0.8158 Intermediate Similarity NPC195155
0.8158 Intermediate Similarity NPC174964
0.8158 Intermediate Similarity NPC21220
0.8133 Intermediate Similarity NPC81759
0.8125 Intermediate Similarity NPC328007
0.8125 Intermediate Similarity NPC268040
0.8108 Intermediate Similarity NPC477850
0.8056 Intermediate Similarity NPC42060
0.8052 Intermediate Similarity NPC472486
0.8052 Intermediate Similarity NPC475742
0.8052 Intermediate Similarity NPC5767
0.8052 Intermediate Similarity NPC4209
0.8052 Intermediate Similarity NPC472487
0.8026 Intermediate Similarity NPC477930
0.8025 Intermediate Similarity NPC217559
0.8025 Intermediate Similarity NPC292458
0.8025 Intermediate Similarity NPC327451
0.8025 Intermediate Similarity NPC268578
0.8025 Intermediate Similarity NPC472744
0.8 Intermediate Similarity NPC89310
0.8 Intermediate Similarity NPC469940
0.8 Intermediate Similarity NPC469745
0.7973 Intermediate Similarity NPC196197
0.7949 Intermediate Similarity NPC207010
0.7949 Intermediate Similarity NPC317913
0.7949 Intermediate Similarity NPC143133
0.7949 Intermediate Similarity NPC298168
0.7949 Intermediate Similarity NPC221420
0.7949 Intermediate Similarity NPC171658
0.7922 Intermediate Similarity NPC472311
0.7901 Intermediate Similarity NPC121121
0.7895 Intermediate Similarity NPC153719
0.7867 Intermediate Similarity NPC108131
0.7848 Intermediate Similarity NPC185465
0.7848 Intermediate Similarity NPC80089
0.7848 Intermediate Similarity NPC34046
0.7848 Intermediate Similarity NPC224802
0.7848 Intermediate Similarity NPC324700
0.7848 Intermediate Similarity NPC171426
0.7838 Intermediate Similarity NPC260319
0.7838 Intermediate Similarity NPC180777
0.7838 Intermediate Similarity NPC474954
0.7838 Intermediate Similarity NPC2568
0.7838 Intermediate Similarity NPC103647
0.7826 Intermediate Similarity NPC476735
0.7821 Intermediate Similarity NPC477933
0.7821 Intermediate Similarity NPC477932
0.7808 Intermediate Similarity NPC268736
0.7808 Intermediate Similarity NPC477931
0.7805 Intermediate Similarity NPC245866
0.7805 Intermediate Similarity NPC175410
0.7792 Intermediate Similarity NPC133922
0.7778 Intermediate Similarity NPC159654
0.7778 Intermediate Similarity NPC58631
0.7778 Intermediate Similarity NPC167995
0.7778 Intermediate Similarity NPC281540
0.7778 Intermediate Similarity NPC164210
0.7778 Intermediate Similarity NPC118937
0.775 Intermediate Similarity NPC320144
0.775 Intermediate Similarity NPC472310
0.775 Intermediate Similarity NPC80891
0.775 Intermediate Similarity NPC201459
0.775 Intermediate Similarity NPC201276
0.775 Intermediate Similarity NPC52951
0.7738 Intermediate Similarity NPC80700
0.7738 Intermediate Similarity NPC92139
0.7738 Intermediate Similarity NPC472745
0.7733 Intermediate Similarity NPC470830
0.7733 Intermediate Similarity NPC299948
0.7733 Intermediate Similarity NPC241085
0.7733 Intermediate Similarity NPC107919
0.7733 Intermediate Similarity NPC474962
0.7722 Intermediate Similarity NPC477918
0.7711 Intermediate Similarity NPC264665
0.7711 Intermediate Similarity NPC74595
0.7703 Intermediate Similarity NPC478180
0.7703 Intermediate Similarity NPC474221
0.7703 Intermediate Similarity NPC130459
0.7692 Intermediate Similarity NPC317242
0.7692 Intermediate Similarity NPC159789
0.7692 Intermediate Similarity NPC477934
0.7683 Intermediate Similarity NPC242771
0.7683 Intermediate Similarity NPC100366
0.7683 Intermediate Similarity NPC164289
0.7683 Intermediate Similarity NPC311642
0.7683 Intermediate Similarity NPC145143
0.7674 Intermediate Similarity NPC116146
0.7674 Intermediate Similarity NPC24772
0.7674 Intermediate Similarity NPC476733
0.7674 Intermediate Similarity NPC215029
0.7671 Intermediate Similarity NPC472946
0.7662 Intermediate Similarity NPC470610
0.7662 Intermediate Similarity NPC474123
0.7647 Intermediate Similarity NPC202937
0.7647 Intermediate Similarity NPC263802
0.7639 Intermediate Similarity NPC114891
0.7632 Intermediate Similarity NPC231945
0.7625 Intermediate Similarity NPC329117
0.7595 Intermediate Similarity NPC470145
0.7595 Intermediate Similarity NPC163597
0.759 Intermediate Similarity NPC86370
0.7568 Intermediate Similarity NPC44122
0.7564 Intermediate Similarity NPC48795
0.7561 Intermediate Similarity NPC103754
0.7561 Intermediate Similarity NPC474484
0.7558 Intermediate Similarity NPC33398
0.7532 Intermediate Similarity NPC290058
0.7529 Intermediate Similarity NPC98236
0.7529 Intermediate Similarity NPC269396
0.7529 Intermediate Similarity NPC80590
0.7528 Intermediate Similarity NPC206878
0.7528 Intermediate Similarity NPC470423
0.75 Intermediate Similarity NPC474996
0.75 Intermediate Similarity NPC66105
0.75 Intermediate Similarity NPC192046
0.75 Intermediate Similarity NPC105208
0.75 Intermediate Similarity NPC71460
0.75 Intermediate Similarity NPC149249
0.75 Intermediate Similarity NPC50438
0.75 Intermediate Similarity NPC477227
0.75 Intermediate Similarity NPC302578
0.75 Intermediate Similarity NPC477820
0.75 Intermediate Similarity NPC106078
0.75 Intermediate Similarity NPC99264
0.75 Intermediate Similarity NPC148174
0.75 Intermediate Similarity NPC128951
0.75 Intermediate Similarity NPC82902
0.75 Intermediate Similarity NPC263974
0.75 Intermediate Similarity NPC218585
0.75 Intermediate Similarity NPC185915
0.7471 Intermediate Similarity NPC24705
0.7471 Intermediate Similarity NPC56962
0.747 Intermediate Similarity NPC61107
0.747 Intermediate Similarity NPC148740
0.747 Intermediate Similarity NPC30583
0.747 Intermediate Similarity NPC102156
0.747 Intermediate Similarity NPC46881
0.747 Intermediate Similarity NPC477858
0.747 Intermediate Similarity NPC170985
0.747 Intermediate Similarity NPC289486
0.7468 Intermediate Similarity NPC72444
0.7467 Intermediate Similarity NPC48079

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC27349 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
0.8873 High Similarity NPD4244 Approved
0.8873 High Similarity NPD4245 Approved
0.8732 High Similarity NPD3698 Phase 2
0.8611 High Similarity NPD4789 Approved
0.8493 Intermediate Similarity NPD4808 Clinical (unspecified phase)
0.8493 Intermediate Similarity NPD4809 Clinical (unspecified phase)
0.8429 Intermediate Similarity NPD3171 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD5361 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD5360 Phase 3
0.8267 Intermediate Similarity NPD6113 Clinical (unspecified phase)
0.8219 Intermediate Similarity NPD3700 Clinical (unspecified phase)
0.8219 Intermediate Similarity NPD3699 Clinical (unspecified phase)
0.8158 Intermediate Similarity NPD3702 Approved
0.8052 Intermediate Similarity NPD6117 Approved
0.8025 Intermediate Similarity NPD4788 Approved
0.7949 Intermediate Similarity NPD6116 Phase 1
0.7848 Intermediate Similarity NPD6697 Approved
0.7848 Intermediate Similarity NPD6118 Approved
0.7848 Intermediate Similarity NPD6115 Approved
0.7848 Intermediate Similarity NPD6114 Approved
0.7808 Intermediate Similarity NPD4224 Phase 2
0.7763 Intermediate Similarity NPD6081 Approved
0.7763 Intermediate Similarity NPD5777 Approved
0.7763 Intermediate Similarity NPD4758 Discontinued
0.7733 Intermediate Similarity NPD4267 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD3703 Phase 2
0.7632 Intermediate Similarity NPD4787 Phase 1
0.7407 Intermediate Similarity NPD5364 Discontinued
0.7407 Intermediate Similarity NPD3671 Phase 1
0.7209 Intermediate Similarity NPD7520 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD4786 Approved
0.7093 Intermediate Similarity NPD3666 Approved
0.7093 Intermediate Similarity NPD3133 Approved
0.7093 Intermediate Similarity NPD3665 Phase 1
0.7079 Intermediate Similarity NPD4753 Phase 2
0.7059 Intermediate Similarity NPD4221 Approved
0.7059 Intermediate Similarity NPD4223 Phase 3
0.7011 Intermediate Similarity NPD5329 Approved
0.6986 Remote Similarity NPD3198 Approved
0.6941 Remote Similarity NPD4139 Approved
0.6941 Remote Similarity NPD4692 Approved
0.6897 Remote Similarity NPD4197 Approved
0.686 Remote Similarity NPD3667 Approved
0.6848 Remote Similarity NPD4202 Approved
0.6742 Remote Similarity NPD4688 Approved
0.6742 Remote Similarity NPD5205 Approved
0.6742 Remote Similarity NPD4690 Approved
0.6742 Remote Similarity NPD4689 Approved
0.6742 Remote Similarity NPD4693 Phase 3
0.6742 Remote Similarity NPD4138 Approved
0.6737 Remote Similarity NPD6084 Phase 2
0.6737 Remote Similarity NPD6083 Phase 2
0.6703 Remote Similarity NPD5328 Approved
0.6702 Remote Similarity NPD4629 Approved
0.6702 Remote Similarity NPD5210 Approved
0.6667 Remote Similarity NPD8170 Clinical (unspecified phase)
0.6628 Remote Similarity NPD6928 Phase 2
0.6588 Remote Similarity NPD3617 Approved
0.6562 Remote Similarity NPD4755 Approved
0.6559 Remote Similarity NPD8034 Phase 2
0.6559 Remote Similarity NPD6079 Approved
0.6559 Remote Similarity NPD8035 Phase 2
0.6556 Remote Similarity NPD5690 Phase 2
0.6556 Remote Similarity NPD5280 Approved
0.6556 Remote Similarity NPD3618 Phase 1
0.6556 Remote Similarity NPD4694 Approved
0.65 Remote Similarity NPD6705 Phase 1
0.6463 Remote Similarity NPD4243 Approved
0.6458 Remote Similarity NPD4697 Phase 3
0.6437 Remote Similarity NPD7525 Registered
0.6429 Remote Similarity NPD5286 Approved
0.6429 Remote Similarity NPD5285 Approved
0.6429 Remote Similarity NPD4700 Approved
0.6429 Remote Similarity NPD4696 Approved
0.6413 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6374 Remote Similarity NPD7146 Approved
0.6374 Remote Similarity NPD6098 Approved
0.6374 Remote Similarity NPD5279 Phase 3
0.6374 Remote Similarity NPD3574 Clinical (unspecified phase)
0.6374 Remote Similarity NPD6409 Approved
0.6374 Remote Similarity NPD7521 Approved
0.6374 Remote Similarity NPD5330 Approved
0.6374 Remote Similarity NPD6684 Approved
0.6374 Remote Similarity NPD7334 Approved
0.6364 Remote Similarity NPD5223 Approved
0.6354 Remote Similarity NPD5695 Phase 3
0.6353 Remote Similarity NPD6933 Approved
0.6353 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6327 Remote Similarity NPD5696 Approved
0.6322 Remote Similarity NPD4195 Approved
0.6316 Remote Similarity NPD6399 Phase 3
0.631 Remote Similarity NPD4785 Approved
0.631 Remote Similarity NPD4784 Approved
0.63 Remote Similarity NPD5225 Approved
0.63 Remote Similarity NPD5226 Approved
0.63 Remote Similarity NPD5224 Approved
0.63 Remote Similarity NPD4633 Approved
0.63 Remote Similarity NPD5211 Phase 2
0.6275 Remote Similarity NPD6402 Approved
0.6275 Remote Similarity NPD5739 Approved
0.6275 Remote Similarity NPD7128 Approved
0.6275 Remote Similarity NPD6675 Approved
0.6263 Remote Similarity NPD8418 Phase 2
0.625 Remote Similarity NPD4748 Discontinued
0.6238 Remote Similarity NPD5175 Approved
0.6238 Remote Similarity NPD4754 Approved
0.6238 Remote Similarity NPD5174 Approved
0.6237 Remote Similarity NPD6903 Approved
0.6235 Remote Similarity NPD6942 Approved
0.6235 Remote Similarity NPD7339 Approved
0.6214 Remote Similarity NPD6412 Phase 2
0.6211 Remote Similarity NPD5281 Approved
0.6211 Remote Similarity NPD5284 Approved
0.619 Remote Similarity NPD4634 Approved
0.6176 Remote Similarity NPD5141 Approved
0.617 Remote Similarity NPD6080 Approved
0.617 Remote Similarity NPD6904 Approved
0.617 Remote Similarity NPD6673 Approved
0.6154 Remote Similarity NPD6881 Approved
0.6154 Remote Similarity NPD3668 Phase 3
0.6154 Remote Similarity NPD7320 Approved
0.6154 Remote Similarity NPD6899 Approved
0.6146 Remote Similarity NPD8171 Discontinued
0.6146 Remote Similarity NPD5133 Approved
0.6122 Remote Similarity NPD5222 Approved
0.6122 Remote Similarity NPD5221 Approved
0.6122 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6118 Remote Similarity NPD6924 Approved
0.6118 Remote Similarity NPD6926 Approved
0.6117 Remote Similarity NPD4768 Approved
0.6117 Remote Similarity NPD4767 Approved
0.6117 Remote Similarity NPD6920 Discontinued
0.6105 Remote Similarity NPD4096 Approved
0.6095 Remote Similarity NPD6373 Approved
0.6095 Remote Similarity NPD6372 Approved
0.6081 Remote Similarity NPD3729 Clinical (unspecified phase)
0.6075 Remote Similarity NPD8297 Approved
0.6064 Remote Similarity NPD6672 Approved
0.6064 Remote Similarity NPD5208 Approved
0.6064 Remote Similarity NPD5737 Approved
0.6061 Remote Similarity NPD5173 Approved
0.6058 Remote Similarity NPD5697 Approved
0.6058 Remote Similarity NPD5701 Approved
0.6047 Remote Similarity NPD4190 Phase 3
0.6047 Remote Similarity NPD5275 Approved
0.6042 Remote Similarity NPD7515 Phase 2
0.6038 Remote Similarity NPD7102 Approved
0.6038 Remote Similarity NPD6883 Approved
0.6038 Remote Similarity NPD7290 Approved
0.602 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6019 Remote Similarity NPD8133 Approved
0.6019 Remote Similarity NPD4632 Approved
0.6 Remote Similarity NPD5128 Approved
0.6 Remote Similarity NPD6011 Approved
0.6 Remote Similarity NPD7507 Approved
0.6 Remote Similarity NPD4729 Approved
0.6 Remote Similarity NPD7909 Approved
0.6 Remote Similarity NPD4730 Approved
0.6 Remote Similarity NPD7638 Approved
0.5981 Remote Similarity NPD6401 Clinical (unspecified phase)
0.5981 Remote Similarity NPD8130 Phase 1
0.5981 Remote Similarity NPD6650 Approved
0.5981 Remote Similarity NPD6617 Approved
0.5981 Remote Similarity NPD6847 Approved
0.5981 Remote Similarity NPD6649 Approved
0.5981 Remote Similarity NPD6869 Approved
0.5957 Remote Similarity NPD4751 Clinical (unspecified phase)
0.5943 Remote Similarity NPD6012 Approved
0.5943 Remote Similarity NPD6013 Approved
0.5943 Remote Similarity NPD6014 Approved
0.5941 Remote Similarity NPD7639 Approved
0.5941 Remote Similarity NPD7640 Approved
0.5926 Remote Similarity NPD6882 Approved
0.5895 Remote Similarity NPD4518 Approved
0.5888 Remote Similarity NPD5250 Approved
0.5888 Remote Similarity NPD5248 Approved
0.5888 Remote Similarity NPD5249 Phase 3
0.5888 Remote Similarity NPD5134 Clinical (unspecified phase)
0.5888 Remote Similarity NPD5169 Approved
0.5888 Remote Similarity NPD5135 Approved
0.5888 Remote Similarity NPD5247 Approved
0.5888 Remote Similarity NPD5251 Approved
0.5876 Remote Similarity NPD6050 Approved
0.5876 Remote Similarity NPD5693 Phase 1
0.5867 Remote Similarity NPD615 Clinical (unspecified phase)
0.5851 Remote Similarity NPD4519 Discontinued
0.5851 Remote Similarity NPD4623 Approved
0.5849 Remote Similarity NPD6415 Discontinued
0.5847 Remote Similarity NPD7319 Approved
0.5843 Remote Similarity NPD4238 Approved
0.5843 Remote Similarity NPD4777 Suspended
0.5843 Remote Similarity NPD4802 Phase 2
0.5843 Remote Similarity NPD4776 Phase 2
0.5833 Remote Similarity NPD5215 Approved
0.5833 Remote Similarity NPD5217 Approved
0.5833 Remote Similarity NPD5216 Approved
0.5833 Remote Similarity NPD5127 Approved
0.5825 Remote Similarity NPD5091 Approved
0.5825 Remote Similarity NPD7632 Discontinued
0.5773 Remote Similarity NPD5692 Phase 3

Structure

External Identifiers

PubChem CID   44575992
ChEMBL   CHEMBL491381
ZINC  

Physicochemical Properties

Molecular Weight:  320.24
ALogP:  -0.4712
MLogP:  3.33
XLogP:  4.445
# Rotatable Bonds:  6
Polar Surface Area:  57.53
# H-Bond Aceptor:  3
# H-Bond Donor:  2
# Rings:  4
# Heavy Atoms:  23

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