Natural Product: NPC63186

Natural Product ID:  NPC63186
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C31H34O8
Standard InCHIKey:  CUGZBEHTWRBHKV-AOSINFTKSA-N
Standard InCHI:  InChI=1S/C31H34O8/c1-11-14-7-17(14)28(4)15(11)8-16-12(2)27(35)38-31(16)20(28)10-30(39-36)19-9-18(19)29(5)24(30)22(31)21(23(32)25(29)33)13(3)26(34)37-6/h14-15,17-20,25,33,36H,1,7-10H2,2-6H3/b21-13-/t14-,15+,17-,18-,19+,20+,25+,28-,29+,30+,31+/m1/s1
Canonical SMILES:  COC(=O)/C(=C/1C(=O)[C@H](O)[C@@]2(C3=C1[C@]14OC(=O)C(=C1C[C@@H]1[C@]([C@@H]4C[C@]3(OO)[C@@H]3[C@H]2C3)(C)[C@@H]2C[C@@H]2C1=C)C)C)/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
NPO3740 Trisetum flavescens Species Poaceae Eukaryota UNPD*
NPO11257 Momordica dioica Species Cucurbitaceae Eukaryota UNPD*
NPO11555 Pterocaulon purpurascens Species Asteraceae Eukaryota UNPD*
NPO8484 Codonopsis lanceolata Species Campanulaceae Eukaryota UNPD*
NPO5827 Dalea tuberculata Species Fabaceae Eukaryota UNPD*
NPO5013 Loranthus spicatus Species Loranthaceae Eukaryota UNPD*
NPO2300 Actinidia deliciosa Species Actinidiaceae Eukaryota UNPD*
NPO468 Dryopteris oligophlebia Species Dryopteridaceae Eukaryota UNPD*
NPO17386 Securidaca longepedunculata Species Polygalaceae Eukaryota UNPD*
NPO16164 Podocarpus urbani Species Podocarpaceae Eukaryota UNPD*
NPO936 Pinalia spicata Species Orchidaceae Eukaryota UNPD*
NPO3385 Cassine transvaalensis Species Celastraceae Eukaryota UNPD*
NPO6256 Eucalyptus umbra Species Myrtaceae Eukaryota UNPD*
NPO11097 Lepidium apetalum Species Brassicaceae Eukaryota UNPD*
NPO1185 Stereocaulon strictum Species Stereocaulaceae Eukaryota UNPD*
NPO9512 Phlomis fruticosa Species Lamiaceae Eukaryota UNPD*
NPO9928 Cephalaria cilicica Species Caprifoliaceae Eukaryota UNPD*
NPO5392 Pachycereus pecten-aboriginum Species Cactaceae Eukaryota UNPD*
NPO11815 Mikania hirsutissima Species Asteraceae Eukaryota UNPD*
NPO12192 Coronilla scorpioides Species Fabaceae Eukaryota UNPD*
NPO7345 Ptilonia magellanica Species Bonnemaisoniaceae Eukaryota UNPD*
NPO9307 Ficus indica Species Ficidae Eukaryota UNPD*
NPO12891 Minasia alpestris Species Asteraceae Eukaryota UNPD*
NPO9040 Elsinoe annonae Species Elsinoaceae Eukaryota UNPD*
NPO19898 Stevia lucida Species Asteraceae Eukaryota UNPD*
NPO10738 Cotoneaster horizontalis Species Rosaceae Eukaryota UNPD*
NPO10399 Manfreda virginica Species Asparagaceae Eukaryota UNPD*
NPO12998 Salvia rubescens Species Lamiaceae Eukaryota UNPD*
NPO6674 Burkholderia ambifaria Species Burkholderiaceae Bacteria UNPD*
NPO7048 Eucalyptus rariflora Species Myrtaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT113 Cell Line RAW264.7 Mus musculus Inhibition < 50 % 27177824

  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 NPC63186 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
0.9344 High Similarity NPC469674
0.8699 High Similarity NPC15095
0.8692 High Similarity NPC25887
0.8615 High Similarity NPC476825
0.8571 High Similarity NPC279478
0.8571 High Similarity NPC241935
0.8504 High Similarity NPC34963
0.8492 Intermediate Similarity NPC35109
0.8485 Intermediate Similarity NPC470426
0.8443 Intermediate Similarity NPC17938
0.8438 Intermediate Similarity NPC469673
0.8438 Intermediate Similarity NPC58029
0.8425 Intermediate Similarity NPC220757
0.8425 Intermediate Similarity NPC196921
0.8372 Intermediate Similarity NPC476823
0.8306 Intermediate Similarity NPC27335
0.8279 Intermediate Similarity NPC118638
0.8264 Intermediate Similarity NPC270958
0.825 Intermediate Similarity NPC202889
0.8217 Intermediate Similarity NPC476824
0.8167 Intermediate Similarity NPC71348
0.816 Intermediate Similarity NPC222688
0.8154 Intermediate Similarity NPC24599
0.8154 Intermediate Similarity NPC476097
0.8154 Intermediate Similarity NPC327664
0.8154 Intermediate Similarity NPC470427
0.8151 Intermediate Similarity NPC473036
0.8151 Intermediate Similarity NPC272898
0.8145 Intermediate Similarity NPC109973
0.8115 Intermediate Similarity NPC266728
0.8115 Intermediate Similarity NPC49492
0.8115 Intermediate Similarity NPC148458
0.8099 Intermediate Similarity NPC962
0.8095 Intermediate Similarity NPC84865
0.8092 Intermediate Similarity NPC60150
0.8092 Intermediate Similarity NPC192334
0.8067 Intermediate Similarity NPC286174
0.8067 Intermediate Similarity NPC77947
0.8065 Intermediate Similarity NPC475041
0.8065 Intermediate Similarity NPC305260
0.8065 Intermediate Similarity NPC270850
0.8062 Intermediate Similarity NPC221414
0.8062 Intermediate Similarity NPC134902
0.8049 Intermediate Similarity NPC239273
0.8034 Intermediate Similarity NPC28656
0.8033 Intermediate Similarity NPC178289
0.8031 Intermediate Similarity NPC226049
0.8017 Intermediate Similarity NPC119601
0.8017 Intermediate Similarity NPC475524
0.8017 Intermediate Similarity NPC100267
0.8017 Intermediate Similarity NPC221144
0.8017 Intermediate Similarity NPC170487
0.8017 Intermediate Similarity NPC308726
0.8016 Intermediate Similarity NPC269642
0.8 Intermediate Similarity NPC179642
0.8 Intermediate Similarity NPC254823
0.8 Intermediate Similarity NPC129689
0.8 Intermediate Similarity NPC19336
0.8 Intermediate Similarity NPC185876
0.7984 Intermediate Similarity NPC311554
0.7984 Intermediate Similarity NPC257457
0.7984 Intermediate Similarity NPC470420
0.7967 Intermediate Similarity NPC190286
0.7967 Intermediate Similarity NPC196931
0.7966 Intermediate Similarity NPC469607
0.7953 Intermediate Similarity NPC473979
0.7953 Intermediate Similarity NPC120724
0.7951 Intermediate Similarity NPC471204
0.7951 Intermediate Similarity NPC250109
0.7951 Intermediate Similarity NPC472926
0.7949 Intermediate Similarity NPC55872
0.7934 Intermediate Similarity NPC214797
0.7934 Intermediate Similarity NPC118860
0.7934 Intermediate Similarity NPC115303
0.7934 Intermediate Similarity NPC231589
0.7931 Intermediate Similarity NPC302537
0.7931 Intermediate Similarity NPC163372
0.7923 Intermediate Similarity NPC231529
0.7923 Intermediate Similarity NPC470880
0.792 Intermediate Similarity NPC9674
0.792 Intermediate Similarity NPC5292
0.792 Intermediate Similarity NPC472933
0.792 Intermediate Similarity NPC19028
0.792 Intermediate Similarity NPC180640
0.7917 Intermediate Similarity NPC304495
0.7917 Intermediate Similarity NPC241927
0.7917 Intermediate Similarity NPC258543
0.7907 Intermediate Similarity NPC287423
0.7907 Intermediate Similarity NPC473265
0.7907 Intermediate Similarity NPC470882
0.7907 Intermediate Similarity NPC473253
0.7903 Intermediate Similarity NPC472927
0.7886 Intermediate Similarity NPC474872
0.7881 Intermediate Similarity NPC96268
0.7869 Intermediate Similarity NPC475391
0.7869 Intermediate Similarity NPC280782
0.7857 Intermediate Similarity NPC474585
0.7857 Intermediate Similarity NPC472004
0.7857 Intermediate Similarity NPC79579
0.7851 Intermediate Similarity NPC197428
0.7851 Intermediate Similarity NPC206595
0.7851 Intermediate Similarity NPC321556
0.7846 Intermediate Similarity NPC311534
0.7846 Intermediate Similarity NPC236999
0.7845 Intermediate Similarity NPC327431
0.784 Intermediate Similarity NPC153440
0.784 Intermediate Similarity NPC472760
0.7833 Intermediate Similarity NPC94529
0.7833 Intermediate Similarity NPC476479
0.7823 Intermediate Similarity NPC469794
0.7823 Intermediate Similarity NPC72772
0.782 Intermediate Similarity NPC478072
0.7815 Intermediate Similarity NPC28791
0.7815 Intermediate Similarity NPC196528
0.7815 Intermediate Similarity NPC51452
0.7815 Intermediate Similarity NPC323834
0.7805 Intermediate Similarity NPC71889
0.7805 Intermediate Similarity NPC474937
0.7805 Intermediate Similarity NPC52634
0.7805 Intermediate Similarity NPC312017
0.7805 Intermediate Similarity NPC194100
0.7805 Intermediate Similarity NPC9848
0.7803 Intermediate Similarity NPC471855
0.7797 Intermediate Similarity NPC140723
0.7797 Intermediate Similarity NPC159442
0.7797 Intermediate Similarity NPC251017
0.7797 Intermediate Similarity NPC236390
0.7797 Intermediate Similarity NPC36688
0.7795 Intermediate Similarity NPC310511
0.7795 Intermediate Similarity NPC472000
0.7795 Intermediate Similarity NPC46570
0.7795 Intermediate Similarity NPC471999
0.7787 Intermediate Similarity NPC174471
0.7787 Intermediate Similarity NPC470281
0.7787 Intermediate Similarity NPC207689
0.7787 Intermediate Similarity NPC260786
0.7787 Intermediate Similarity NPC474871
0.7787 Intermediate Similarity NPC472928
0.7787 Intermediate Similarity NPC43775
0.7787 Intermediate Similarity NPC96739
0.776 Intermediate Similarity NPC474518
0.776 Intermediate Similarity NPC471854
0.776 Intermediate Similarity NPC153651
0.776 Intermediate Similarity NPC472934
0.776 Intermediate Similarity NPC284068
0.7752 Intermediate Similarity NPC145238
0.7752 Intermediate Similarity NPC469790
0.7752 Intermediate Similarity NPC473255
0.775 Intermediate Similarity NPC251824
0.775 Intermediate Similarity NPC472925
0.775 Intermediate Similarity NPC86852
0.775 Intermediate Similarity NPC473037
0.775 Intermediate Similarity NPC475294
0.7744 Intermediate Similarity NPC88668
0.7742 Intermediate Similarity NPC474181
0.7742 Intermediate Similarity NPC123117
0.7739 Intermediate Similarity NPC96859
0.7739 Intermediate Similarity NPC305483
0.7739 Intermediate Similarity NPC328162
0.7734 Intermediate Similarity NPC107493
0.7734 Intermediate Similarity NPC470419
0.7731 Intermediate Similarity NPC235889
0.7731 Intermediate Similarity NPC477812
0.7731 Intermediate Similarity NPC29705
0.7724 Intermediate Similarity NPC476163
0.7724 Intermediate Similarity NPC215643
0.7724 Intermediate Similarity NPC475970
0.7724 Intermediate Similarity NPC265499
0.7724 Intermediate Similarity NPC101825
0.7724 Intermediate Similarity NPC89227
0.7724 Intermediate Similarity NPC170212
0.7724 Intermediate Similarity NPC17138
0.7724 Intermediate Similarity NPC151216
0.7724 Intermediate Similarity NPC221511
0.7717 Intermediate Similarity NPC471126
0.7717 Intermediate Similarity NPC476962
0.7717 Intermediate Similarity NPC157252
0.7717 Intermediate Similarity NPC471128
0.7717 Intermediate Similarity NPC145182
0.7712 Intermediate Similarity NPC469606
0.7712 Intermediate Similarity NPC31058
0.7712 Intermediate Similarity NPC195290
0.7712 Intermediate Similarity NPC273005
0.7712 Intermediate Similarity NPC204450
0.7712 Intermediate Similarity NPC56498
0.7712 Intermediate Similarity NPC22388
0.771 Intermediate Similarity NPC473888
0.7705 Intermediate Similarity NPC210005
0.7705 Intermediate Similarity NPC163314
0.7705 Intermediate Similarity NPC6206
0.7705 Intermediate Similarity NPC76084
0.7698 Intermediate Similarity NPC146786
0.7692 Intermediate Similarity NPC205899
0.7687 Intermediate Similarity NPC471234
0.7686 Intermediate Similarity NPC295244
0.7686 Intermediate Similarity NPC470269
0.7686 Intermediate Similarity NPC275539
0.7686 Intermediate Similarity NPC211224
0.7686 Intermediate Similarity NPC189075
0.768 Intermediate Similarity NPC176840

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC63186 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
0.7983 Intermediate Similarity NPD7320 Approved
0.7917 Intermediate Similarity NPD6372 Approved
0.7917 Intermediate Similarity NPD6373 Approved
0.7815 Intermediate Similarity NPD7128 Approved
0.7815 Intermediate Similarity NPD6402 Approved
0.7815 Intermediate Similarity NPD6008 Approved
0.7815 Intermediate Similarity NPD5739 Approved
0.7815 Intermediate Similarity NPD6675 Approved
0.7787 Intermediate Similarity NPD6650 Approved
0.7787 Intermediate Similarity NPD6649 Approved
0.7686 Intermediate Similarity NPD6881 Approved
0.7686 Intermediate Similarity NPD6899 Approved
0.7603 Intermediate Similarity NPD5697 Approved
0.7603 Intermediate Similarity NPD5701 Approved
0.7581 Intermediate Similarity NPD8297 Approved
0.7581 Intermediate Similarity NPD6882 Approved
0.7581 Intermediate Similarity NPD6053 Discontinued
0.7561 Intermediate Similarity NPD6883 Approved
0.7561 Intermediate Similarity NPD7290 Approved
0.7561 Intermediate Similarity NPD7102 Approved
0.7557 Intermediate Similarity NPD7507 Approved
0.7541 Intermediate Similarity NPD6011 Approved
0.7538 Intermediate Similarity NPD7604 Phase 2
0.752 Intermediate Similarity NPD4632 Approved
0.75 Intermediate Similarity NPD6869 Approved
0.75 Intermediate Similarity NPD6617 Approved
0.75 Intermediate Similarity NPD7078 Approved
0.75 Intermediate Similarity NPD8130 Phase 1
0.75 Intermediate Similarity NPD6847 Approved
0.75 Intermediate Similarity NPD6401 Clinical (unspecified phase)
0.748 Intermediate Similarity NPD6013 Approved
0.748 Intermediate Similarity NPD6012 Approved
0.748 Intermediate Similarity NPD6014 Approved
0.7458 Intermediate Similarity NPD7638 Approved
0.7442 Intermediate Similarity NPD6319 Approved
0.7395 Intermediate Similarity NPD7640 Approved
0.7395 Intermediate Similarity NPD7639 Approved
0.7388 Intermediate Similarity NPD7319 Approved
0.7373 Intermediate Similarity NPD4755 Approved
0.7348 Intermediate Similarity NPD7492 Approved
0.7344 Intermediate Similarity NPD6009 Approved
0.7308 Intermediate Similarity NPD6054 Approved
0.7308 Intermediate Similarity NPD6059 Approved
0.7293 Intermediate Similarity NPD6616 Approved
0.728 Intermediate Similarity NPD5955 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD5211 Phase 2
0.7252 Intermediate Similarity NPD5983 Phase 2
0.725 Intermediate Similarity NPD4700 Approved
0.725 Intermediate Similarity NPD5286 Approved
0.725 Intermediate Similarity NPD5285 Approved
0.725 Intermediate Similarity NPD4696 Approved
0.7239 Intermediate Similarity NPD8293 Discontinued
0.7227 Intermediate Similarity NPD6083 Phase 2
0.7227 Intermediate Similarity NPD6084 Phase 2
0.7209 Intermediate Similarity NPD7115 Discovery
0.7203 Intermediate Similarity NPD6356 Clinical (unspecified phase)
0.7203 Intermediate Similarity NPD5695 Phase 3
0.72 Intermediate Similarity NPD4061 Clinical (unspecified phase)
0.7197 Intermediate Similarity NPD6370 Approved
0.719 Intermediate Similarity NPD5223 Approved
0.7185 Intermediate Similarity NPD7736 Approved
0.7164 Intermediate Similarity NPD6336 Discontinued
0.7154 Intermediate Similarity NPD5141 Approved
0.7154 Intermediate Similarity NPD6335 Approved
0.7153 Intermediate Similarity NPD7260 Phase 2
0.7132 Intermediate Similarity NPD6274 Approved
0.7131 Intermediate Similarity NPD5224 Approved
0.7131 Intermediate Similarity NPD5226 Approved
0.7131 Intermediate Similarity NPD4633 Approved
0.7131 Intermediate Similarity NPD5225 Approved
0.7121 Intermediate Similarity NPD6015 Approved
0.7121 Intermediate Similarity NPD6291 Clinical (unspecified phase)
0.7121 Intermediate Similarity NPD6016 Approved
0.7119 Intermediate Similarity NPD6001 Approved
0.7101 Intermediate Similarity NPD6845 Suspended
0.7099 Intermediate Similarity NPD7100 Approved
0.7099 Intermediate Similarity NPD7101 Approved
0.7097 Intermediate Similarity NPD4767 Approved
0.7097 Intermediate Similarity NPD4768 Approved
0.7094 Intermediate Similarity NPD5284 Approved
0.7094 Intermediate Similarity NPD6050 Approved
0.7094 Intermediate Similarity NPD5281 Approved
0.7077 Intermediate Similarity NPD6317 Approved
0.7073 Intermediate Similarity NPD5174 Approved
0.7073 Intermediate Similarity NPD4754 Approved
0.7073 Intermediate Similarity NPD5175 Approved
0.7068 Intermediate Similarity NPD5988 Approved
0.704 Intermediate Similarity NPD5954 Clinical (unspecified phase)
0.7034 Intermediate Similarity NPD6399 Phase 3
0.7025 Intermediate Similarity NPD5696 Approved
0.7023 Intermediate Similarity NPD7327 Approved
0.7023 Intermediate Similarity NPD6314 Approved
0.7023 Intermediate Similarity NPD6313 Approved
0.7023 Intermediate Similarity NPD7328 Approved
0.7009 Intermediate Similarity NPD5692 Phase 3
0.7008 Intermediate Similarity NPD4634 Approved
0.7 Intermediate Similarity NPD4697 Phase 3
0.6992 Remote Similarity NPD8033 Approved
0.6992 Remote Similarity NPD6908 Approved
0.6992 Remote Similarity NPD6909 Approved
0.6992 Remote Similarity NPD7632 Discontinued
0.6984 Remote Similarity NPD4730 Approved
0.6984 Remote Similarity NPD4729 Approved
0.697 Remote Similarity NPD7516 Approved
0.6949 Remote Similarity NPD5693 Phase 1
0.6949 Remote Similarity NPD5694 Approved
0.6934 Remote Similarity NPD6033 Approved
0.6923 Remote Similarity NPD5328 Approved
0.6917 Remote Similarity NPD8377 Approved
0.6917 Remote Similarity NPD8294 Approved
0.6891 Remote Similarity NPD4202 Approved
0.6875 Remote Similarity NPD5250 Approved
0.6875 Remote Similarity NPD5247 Approved
0.6875 Remote Similarity NPD5249 Phase 3
0.6875 Remote Similarity NPD5248 Approved
0.6875 Remote Similarity NPD5251 Approved
0.6866 Remote Similarity NPD8380 Approved
0.6866 Remote Similarity NPD8378 Approved
0.6866 Remote Similarity NPD7503 Approved
0.6866 Remote Similarity NPD8379 Approved
0.6866 Remote Similarity NPD8296 Approved
0.6866 Remote Similarity NPD8335 Approved
0.6864 Remote Similarity NPD5207 Approved
0.686 Remote Similarity NPD5220 Clinical (unspecified phase)
0.686 Remote Similarity NPD5222 Approved
0.686 Remote Similarity NPD5221 Approved
0.685 Remote Similarity NPD5128 Approved
0.6838 Remote Similarity NPD6903 Approved
0.681 Remote Similarity NPD4694 Approved
0.681 Remote Similarity NPD5279 Phase 3
0.681 Remote Similarity NPD5280 Approved
0.6807 Remote Similarity NPD6079 Approved
0.6803 Remote Similarity NPD5173 Approved
0.6803 Remote Similarity NPD5959 Approved
0.678 Remote Similarity NPD6673 Approved
0.678 Remote Similarity NPD6904 Approved
0.678 Remote Similarity NPD4753 Phase 2
0.678 Remote Similarity NPD6080 Approved
0.6744 Remote Similarity NPD6371 Approved
0.6744 Remote Similarity NPD5134 Clinical (unspecified phase)
0.6744 Remote Similarity NPD5135 Approved
0.6744 Remote Similarity NPD5169 Approved
0.6742 Remote Similarity NPD6868 Approved
0.6719 Remote Similarity NPD6686 Approved
0.6719 Remote Similarity NPD5345 Clinical (unspecified phase)
0.6695 Remote Similarity NPD6672 Approved
0.6695 Remote Similarity NPD5737 Approved
0.6692 Remote Similarity NPD5216 Approved
0.6692 Remote Similarity NPD5217 Approved
0.6692 Remote Similarity NPD5215 Approved
0.6692 Remote Similarity NPD5127 Approved
0.6667 Remote Similarity NPD6684 Approved
0.6667 Remote Similarity NPD7146 Approved
0.6667 Remote Similarity NPD7521 Approved
0.6667 Remote Similarity NPD5330 Approved
0.6667 Remote Similarity NPD3618 Phase 1
0.6667 Remote Similarity NPD7334 Approved
0.6667 Remote Similarity NPD6409 Approved
0.6667 Remote Similarity NPD7902 Approved
0.6642 Remote Similarity NPD8328 Phase 3
0.6641 Remote Similarity NPD6412 Phase 2
0.6641 Remote Similarity NPD7899 Clinical (unspecified phase)
0.6639 Remote Similarity NPD5210 Approved
0.6639 Remote Similarity NPD4629 Approved
0.6639 Remote Similarity NPD5654 Approved
0.6623 Remote Similarity NPD7236 Approved
0.6621 Remote Similarity NPD6334 Approved
0.6621 Remote Similarity NPD6333 Approved
0.6612 Remote Similarity NPD5778 Approved
0.6612 Remote Similarity NPD5779 Approved
0.6612 Remote Similarity NPD5133 Approved
0.6581 Remote Similarity NPD5329 Approved
0.6557 Remote Similarity NPD7748 Approved
0.6555 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6541 Remote Similarity NPD5167 Approved
0.6529 Remote Similarity NPD7515 Phase 2
0.6529 Remote Similarity NPD6411 Approved
0.6529 Remote Similarity NPD8034 Phase 2
0.6529 Remote Similarity NPD8035 Phase 2
0.6525 Remote Similarity NPD5690 Phase 2
0.6525 Remote Similarity NPD6098 Approved
0.6516 Remote Similarity NPD7239 Suspended
0.6496 Remote Similarity NPD8517 Approved
0.6496 Remote Similarity NPD3665 Phase 1
0.6496 Remote Similarity NPD8513 Phase 3
0.6496 Remote Similarity NPD3666 Approved
0.6496 Remote Similarity NPD4197 Approved
0.6496 Remote Similarity NPD8515 Approved
0.6496 Remote Similarity NPD8516 Approved
0.6496 Remote Similarity NPD4786 Approved
0.6496 Remote Similarity NPD3133 Approved
0.6466 Remote Similarity NPD8133 Approved
0.6446 Remote Similarity NPD5785 Approved
0.6444 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6423 Remote Similarity NPD7900 Approved
0.6423 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6412 Remote Similarity NPD8132 Clinical (unspecified phase)
0.6403 Remote Similarity NPD6067 Discontinued
0.6364 Remote Similarity NPD6101 Approved
0.6364 Remote Similarity NPD6051 Approved

Structure

External Identifiers

PubChem CID   54671620
ChEMBL   CHEMBL3809663
ZINC  

Physicochemical Properties

Molecular Weight:  534.23
ALogP:  0.9296
MLogP:  3.99
XLogP:  1.743
# Rotatable Bonds:  10
Polar Surface Area:  119.36
# H-Bond Aceptor:  8
# H-Bond Donor:  2
# Rings:  8
# Heavy Atoms:  39

Download Data

Data Type Select
General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs