Natural Product: NPC475163

Natural Product ID:  NPC475163
Common Name:   3-O-Deacetyl-13,14-Z-Stelliferin Riboside
IUPAC Name:   (3Z,3aS,5aR,7R,9aR,9bS)-3-[(3E,5E)-6,10-dimethyl-7-[(2R,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxyundeca-3,5,9-trien-2-ylidene]-7-hydroxy-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-2-one
Synonyms:  
Molecular Formula:   C35H54O7
Standard InCHIKey:  CVGCKYFLYRWSIQ-CYDYFIDXSA-N
Standard InCHI:  InChI=1S/C35H54O7/c1-20(2)12-13-25(42-32-31(40)30(39)24(37)19-41-32)21(3)10-9-11-22(4)29-23(36)18-27-34(7)17-15-28(38)33(5,6)26(34)14-16-35(27,29)8/h9-12,24-28,30-32,37-40H,13-19H2,1-8H3/b11-9+,21-10+,29-22+/t24-,25?,26+,27+,28-,30-,31-,32-,34+,35+/m1/s1
Canonical SMILES:  CC(=CCC(/C(=C/C=C/C(=C/1C(=O)C[C@@H]2[C@]1(C)CC[C@@H]1[C@]2(C)CC[C@H](C1(C)C)O)/C)/C)O[C@H]1OC[C@H]([C@H]([C@H]1O)O)O)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
NPO28502 Rhabdastrella globostellata Species Ancorinidae Eukaryota PMID[16499318]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT681 Cell Line PC-12 Rattus norvegicus ED50 = 27.63 nmol PubChem BioAssay data set
NPT1864 Cell Line L5178Y Mus musculus Inhibition = 100 % DrugMatrix in vivo data: Biochemistry
NPT681 Cell Line PC-12 Rattus norvegicus Inhibition = 33 % 10924160
NPT681 Cell Line PC-12 Rattus norvegicus Inhibition = 54 % 18625769
NPT165 Cell Line HeLa Homo sapiens Inhibition = 100 % 25760525
NPT1864 Cell Line L5178Y Mus musculus ED50 = 2.4 nmol 21458279
NPT165 Cell Line HeLa Homo sapiens ED50 = 8.14 nmol 20627740
NPT19 Organism Escherichia coli Escherichia coli IZ = 12 mm 10924160
NPT1864 Cell Line L5178Y Mus musculus Inhibition = 100 % 24012378
NPT165 Cell Line HeLa Homo sapiens Inhibition = 26 % PubChem BioAssay data set

  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 NPC475163 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
0.9722 High Similarity NPC473828
0.9722 High Similarity NPC473617
0.8696 High Similarity NPC470312
0.8684 High Similarity NPC45475
0.8661 High Similarity NPC260665
0.8636 High Similarity NPC475065
0.8636 High Similarity NPC246205
0.8632 High Similarity NPC41129
0.8598 High Similarity NPC114540
0.8598 High Similarity NPC155332
0.8598 High Similarity NPC32577
0.8584 High Similarity NPC74727
0.8583 High Similarity NPC476966
0.8583 High Similarity NPC471407
0.8559 High Similarity NPC475317
0.8559 High Similarity NPC154856
0.8559 High Similarity NPC52241
0.8545 High Similarity NPC473482
0.8545 High Similarity NPC318363
0.8545 High Similarity NPC475418
0.85 High Similarity NPC245094
0.8482 Intermediate Similarity NPC292196
0.8462 Intermediate Similarity NPC202051
0.8455 Intermediate Similarity NPC330011
0.8455 Intermediate Similarity NPC329048
0.8448 Intermediate Similarity NPC477071
0.8443 Intermediate Similarity NPC471855
0.8443 Intermediate Similarity NPC231240
0.8435 Intermediate Similarity NPC474483
0.8421 Intermediate Similarity NPC477580
0.8421 Intermediate Similarity NPC220293
0.8407 Intermediate Similarity NPC210420
0.8407 Intermediate Similarity NPC130427
0.8407 Intermediate Similarity NPC474265
0.8403 Intermediate Similarity NPC318135
0.8393 Intermediate Similarity NPC83005
0.8393 Intermediate Similarity NPC119550
0.839 Intermediate Similarity NPC28532
0.8378 Intermediate Similarity NPC392
0.8378 Intermediate Similarity NPC177524
0.8378 Intermediate Similarity NPC219900
0.8378 Intermediate Similarity NPC295389
0.8376 Intermediate Similarity NPC476127
0.8376 Intermediate Similarity NPC476150
0.8376 Intermediate Similarity NPC48692
0.8374 Intermediate Similarity NPC316915
0.8364 Intermediate Similarity NPC252296
0.8364 Intermediate Similarity NPC210178
0.8362 Intermediate Similarity NPC291564
0.8362 Intermediate Similarity NPC239293
0.8361 Intermediate Similarity NPC173347
0.8348 Intermediate Similarity NPC473126
0.8348 Intermediate Similarity NPC207637
0.8347 Intermediate Similarity NPC311534
0.8333 Intermediate Similarity NPC62696
0.8333 Intermediate Similarity NPC311592
0.8333 Intermediate Similarity NPC293038
0.8333 Intermediate Similarity NPC75167
0.8333 Intermediate Similarity NPC115899
0.8319 Intermediate Similarity NPC208189
0.8319 Intermediate Similarity NPC263827
0.8319 Intermediate Similarity NPC27363
0.8319 Intermediate Similarity NPC250481
0.8319 Intermediate Similarity NPC269466
0.8319 Intermediate Similarity NPC285410
0.8319 Intermediate Similarity NPC65034
0.8305 Intermediate Similarity NPC476204
0.8305 Intermediate Similarity NPC170084
0.8305 Intermediate Similarity NPC129434
0.8304 Intermediate Similarity NPC316974
0.8304 Intermediate Similarity NPC472216
0.8304 Intermediate Similarity NPC265655
0.8304 Intermediate Similarity NPC40728
0.8304 Intermediate Similarity NPC284828
0.8304 Intermediate Similarity NPC5475
0.8304 Intermediate Similarity NPC173905
0.8291 Intermediate Similarity NPC232258
0.8291 Intermediate Similarity NPC473274
0.8291 Intermediate Similarity NPC190939
0.8291 Intermediate Similarity NPC197003
0.8288 Intermediate Similarity NPC184512
0.8288 Intermediate Similarity NPC33053
0.8288 Intermediate Similarity NPC473284
0.8279 Intermediate Similarity NPC473593
0.8273 Intermediate Similarity NPC222161
0.8273 Intermediate Similarity NPC93352
0.8264 Intermediate Similarity NPC42399
0.8264 Intermediate Similarity NPC329784
0.8264 Intermediate Similarity NPC240070
0.8261 Intermediate Similarity NPC165439
0.8261 Intermediate Similarity NPC181145
0.8261 Intermediate Similarity NPC473882
0.8261 Intermediate Similarity NPC474557
0.8261 Intermediate Similarity NPC102088
0.8261 Intermediate Similarity NPC472274
0.8257 Intermediate Similarity NPC470571
0.8246 Intermediate Similarity NPC471967
0.8246 Intermediate Similarity NPC470025
0.8246 Intermediate Similarity NPC321272
0.8246 Intermediate Similarity NPC231797
0.8246 Intermediate Similarity NPC477253
0.8246 Intermediate Similarity NPC317460
0.8246 Intermediate Similarity NPC328074
0.8241 Intermediate Similarity NPC266955
0.824 Intermediate Similarity NPC158350
0.823 Intermediate Similarity NPC129340
0.823 Intermediate Similarity NPC316708
0.823 Intermediate Similarity NPC101450
0.8224 Intermediate Similarity NPC474785
0.8224 Intermediate Similarity NPC474938
0.8224 Intermediate Similarity NPC110937
0.822 Intermediate Similarity NPC473130
0.822 Intermediate Similarity NPC129393
0.822 Intermediate Similarity NPC472075
0.822 Intermediate Similarity NPC472076
0.822 Intermediate Similarity NPC472257
0.8214 Intermediate Similarity NPC135015
0.8214 Intermediate Similarity NPC128795
0.8214 Intermediate Similarity NPC217921
0.8214 Intermediate Similarity NPC195708
0.8214 Intermediate Similarity NPC311223
0.8214 Intermediate Similarity NPC48548
0.8214 Intermediate Similarity NPC272576
0.8205 Intermediate Similarity NPC234522
0.8198 Intermediate Similarity NPC63023
0.8198 Intermediate Similarity NPC218158
0.8198 Intermediate Similarity NPC82251
0.8198 Intermediate Similarity NPC266570
0.8198 Intermediate Similarity NPC162033
0.8198 Intermediate Similarity NPC95243
0.819 Intermediate Similarity NPC471816
0.819 Intermediate Similarity NPC279638
0.8182 Intermediate Similarity NPC250556
0.8182 Intermediate Similarity NPC134270
0.8182 Intermediate Similarity NPC469750
0.8174 Intermediate Similarity NPC470027
0.8174 Intermediate Similarity NPC178981
0.8174 Intermediate Similarity NPC477944
0.8174 Intermediate Similarity NPC264153
0.8174 Intermediate Similarity NPC251309
0.8165 Intermediate Similarity NPC21568
0.8165 Intermediate Similarity NPC285231
0.8165 Intermediate Similarity NPC267510
0.8158 Intermediate Similarity NPC17791
0.8158 Intermediate Similarity NPC470026
0.8158 Intermediate Similarity NPC190837
0.8151 Intermediate Similarity NPC473256
0.8151 Intermediate Similarity NPC470878
0.8151 Intermediate Similarity NPC476675
0.8148 Intermediate Similarity NPC57079
0.8148 Intermediate Similarity NPC108368
0.8145 Intermediate Similarity NPC155529
0.8142 Intermediate Similarity NPC472901
0.8142 Intermediate Similarity NPC8431
0.8142 Intermediate Similarity NPC118225
0.8136 Intermediate Similarity NPC473270
0.8136 Intermediate Similarity NPC29639
0.8136 Intermediate Similarity NPC122971
0.8136 Intermediate Similarity NPC476529
0.8136 Intermediate Similarity NPC475775
0.8136 Intermediate Similarity NPC153085
0.8136 Intermediate Similarity NPC44899
0.8136 Intermediate Similarity NPC5883
0.8136 Intermediate Similarity NPC268326
0.8136 Intermediate Similarity NPC304260
0.813 Intermediate Similarity NPC329986
0.813 Intermediate Similarity NPC140092
0.813 Intermediate Similarity NPC232785
0.813 Intermediate Similarity NPC125077
0.813 Intermediate Similarity NPC276838
0.813 Intermediate Similarity NPC188234
0.8125 Intermediate Similarity NPC88013
0.8125 Intermediate Similarity NPC125423
0.8125 Intermediate Similarity NPC293512
0.8125 Intermediate Similarity NPC283849
0.8125 Intermediate Similarity NPC109376
0.812 Intermediate Similarity NPC203862
0.812 Intermediate Similarity NPC477252
0.812 Intermediate Similarity NPC473405
0.812 Intermediate Similarity NPC93883
0.812 Intermediate Similarity NPC473968
0.8115 Intermediate Similarity NPC117702
0.8115 Intermediate Similarity NPC179412
0.8115 Intermediate Similarity NPC298841
0.8115 Intermediate Similarity NPC469757
0.8115 Intermediate Similarity NPC146456
0.8115 Intermediate Similarity NPC471356
0.8115 Intermediate Similarity NPC471357
0.8113 Intermediate Similarity NPC474690
0.8108 Intermediate Similarity NPC473207
0.8108 Intermediate Similarity NPC81567
0.8108 Intermediate Similarity NPC100955
0.8108 Intermediate Similarity NPC75608
0.8108 Intermediate Similarity NPC121566
0.8108 Intermediate Similarity NPC264867
0.8108 Intermediate Similarity NPC470321
0.8108 Intermediate Similarity NPC223741
0.8108 Intermediate Similarity NPC201880
0.8103 Intermediate Similarity NPC69576
0.8103 Intermediate Similarity NPC471633

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC475163 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
0.8455 Intermediate Similarity NPD6412 Phase 2
0.8378 Intermediate Similarity NPD6686 Approved
0.8182 Intermediate Similarity NPD7507 Approved
0.8 Intermediate Similarity NPD8033 Approved
0.8 Intermediate Similarity NPD7503 Approved
0.7984 Intermediate Similarity NPD7319 Approved
0.7917 Intermediate Similarity NPD8377 Approved
0.7917 Intermediate Similarity NPD8294 Approved
0.7899 Intermediate Similarity NPD7327 Approved
0.7899 Intermediate Similarity NPD7328 Approved
0.7851 Intermediate Similarity NPD8380 Approved
0.7851 Intermediate Similarity NPD8296 Approved
0.7851 Intermediate Similarity NPD8378 Approved
0.7851 Intermediate Similarity NPD8379 Approved
0.7851 Intermediate Similarity NPD8335 Approved
0.7833 Intermediate Similarity NPD7516 Approved
0.7818 Intermediate Similarity NPD7638 Approved
0.7815 Intermediate Similarity NPD7115 Discovery
0.7787 Intermediate Similarity NPD6370 Approved
0.7748 Intermediate Similarity NPD7640 Approved
0.7748 Intermediate Similarity NPD7639 Approved
0.7712 Intermediate Similarity NPD8133 Approved
0.7672 Intermediate Similarity NPD8132 Clinical (unspecified phase)
0.7623 Intermediate Similarity NPD6054 Approved
0.7619 Intermediate Similarity NPD7736 Approved
0.7581 Intermediate Similarity NPD8328 Phase 3
0.7561 Intermediate Similarity NPD8515 Approved
0.7561 Intermediate Similarity NPD8516 Approved
0.7561 Intermediate Similarity NPD8517 Approved
0.7561 Intermediate Similarity NPD8513 Phase 3
0.754 Intermediate Similarity NPD8293 Discontinued
0.748 Intermediate Similarity NPD6059 Approved
0.7479 Intermediate Similarity NPD6882 Approved
0.7479 Intermediate Similarity NPD8297 Approved
0.744 Intermediate Similarity NPD6067 Discontinued
0.7419 Intermediate Similarity NPD6016 Approved
0.7419 Intermediate Similarity NPD6015 Approved
0.7381 Intermediate Similarity NPD7492 Approved
0.7377 Intermediate Similarity NPD6009 Approved
0.7373 Intermediate Similarity NPD4061 Clinical (unspecified phase)
0.736 Intermediate Similarity NPD5988 Approved
0.7345 Intermediate Similarity NPD4225 Approved
0.7323 Intermediate Similarity NPD6616 Approved
0.729 Intermediate Similarity NPD3618 Phase 1
0.7288 Intermediate Similarity NPD6899 Approved
0.7288 Intermediate Similarity NPD6881 Approved
0.7273 Intermediate Similarity NPD6079 Approved
0.7273 Intermediate Similarity NPD4632 Approved
0.7266 Intermediate Similarity NPD7078 Approved
0.7265 Intermediate Similarity NPD6675 Approved
0.7265 Intermediate Similarity NPD7128 Approved
0.7265 Intermediate Similarity NPD6402 Approved
0.7265 Intermediate Similarity NPD5739 Approved
0.725 Intermediate Similarity NPD8130 Phase 1
0.7248 Intermediate Similarity NPD5328 Approved
0.7236 Intermediate Similarity NPD8295 Clinical (unspecified phase)
0.7207 Intermediate Similarity NPD6399 Phase 3
0.7203 Intermediate Similarity NPD5697 Approved
0.72 Intermediate Similarity NPD6319 Approved
0.7167 Intermediate Similarity NPD7290 Approved
0.7167 Intermediate Similarity NPD7102 Approved
0.7167 Intermediate Similarity NPD6883 Approved
0.7155 Intermediate Similarity NPD5211 Phase 2
0.7155 Intermediate Similarity NPD7632 Discontinued
0.7143 Intermediate Similarity NPD7320 Approved
0.7143 Intermediate Similarity NPD5345 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7748 Approved
0.713 Intermediate Similarity NPD5286 Approved
0.713 Intermediate Similarity NPD4696 Approved
0.713 Intermediate Similarity NPD5285 Approved
0.7107 Intermediate Similarity NPD6869 Approved
0.7107 Intermediate Similarity NPD6617 Approved
0.7107 Intermediate Similarity NPD6649 Approved
0.7107 Intermediate Similarity NPD6847 Approved
0.7107 Intermediate Similarity NPD6650 Approved
0.7105 Intermediate Similarity NPD4755 Approved
0.7105 Intermediate Similarity NPD7902 Approved
0.7103 Intermediate Similarity NPD4786 Approved
0.7083 Intermediate Similarity NPD6014 Approved
0.7083 Intermediate Similarity NPD6372 Approved
0.7083 Intermediate Similarity NPD6373 Approved
0.7083 Intermediate Similarity NPD6012 Approved
0.7083 Intermediate Similarity NPD6013 Approved
0.7075 Intermediate Similarity NPD3667 Approved
0.7059 Intermediate Similarity NPD5701 Approved
0.7054 Intermediate Similarity NPD4202 Approved
0.7043 Intermediate Similarity NPD8029 Clinical (unspecified phase)
0.7034 Intermediate Similarity NPD5141 Approved
0.7027 Intermediate Similarity NPD46 Approved
0.7027 Intermediate Similarity NPD6698 Approved
0.7025 Intermediate Similarity NPD4634 Approved
0.7025 Intermediate Similarity NPD5955 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD5222 Approved
0.7018 Intermediate Similarity NPD5221 Approved
0.7018 Intermediate Similarity NPD5220 Clinical (unspecified phase)
0.7009 Intermediate Similarity NPD4633 Approved
0.7009 Intermediate Similarity NPD5226 Approved
0.7009 Intermediate Similarity NPD5225 Approved
0.7009 Intermediate Similarity NPD5224 Approved
0.7 Intermediate Similarity NPD6011 Approved
0.7 Intermediate Similarity NPD8074 Phase 3
0.6983 Remote Similarity NPD4700 Approved
0.6967 Remote Similarity NPD8413 Clinical (unspecified phase)
0.6964 Remote Similarity NPD7515 Phase 2
0.6957 Remote Similarity NPD6083 Phase 2
0.6957 Remote Similarity NPD5173 Approved
0.6957 Remote Similarity NPD6084 Phase 2
0.6949 Remote Similarity NPD5174 Approved
0.6949 Remote Similarity NPD5175 Approved
0.6947 Remote Similarity NPD6033 Approved
0.6944 Remote Similarity NPD3133 Approved
0.6944 Remote Similarity NPD3665 Phase 1
0.6944 Remote Similarity NPD3666 Approved
0.6923 Remote Similarity NPD5223 Approved
0.6917 Remote Similarity NPD7260 Phase 2
0.6899 Remote Similarity NPD7604 Phase 2
0.6891 Remote Similarity NPD8170 Clinical (unspecified phase)
0.6875 Remote Similarity NPD7838 Discovery
0.6875 Remote Similarity NPD5983 Phase 2
0.687 Remote Similarity NPD4697 Phase 3
0.6842 Remote Similarity NPD7900 Approved
0.6842 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6833 Remote Similarity NPD6008 Approved
0.6829 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6818 Remote Similarity NPD6409 Approved
0.6818 Remote Similarity NPD7521 Approved
0.6818 Remote Similarity NPD5330 Approved
0.6818 Remote Similarity NPD6684 Approved
0.6818 Remote Similarity NPD7146 Approved
0.6818 Remote Similarity NPD5279 Phase 3
0.6818 Remote Similarity NPD7334 Approved
0.6814 Remote Similarity NPD7637 Suspended
0.6814 Remote Similarity NPD8034 Phase 2
0.6814 Remote Similarity NPD6411 Approved
0.6814 Remote Similarity NPD8035 Phase 2
0.6794 Remote Similarity NPD6336 Discontinued
0.6786 Remote Similarity NPD4753 Phase 2
0.678 Remote Similarity NPD5344 Discontinued
0.6777 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6774 Remote Similarity NPD6053 Discontinued
0.6757 Remote Similarity NPD7524 Approved
0.6721 Remote Similarity NPD4730 Approved
0.6721 Remote Similarity NPD4729 Approved
0.6719 Remote Similarity NPD7100 Approved
0.6719 Remote Similarity NPD7101 Approved
0.6696 Remote Similarity NPD6903 Approved
0.6696 Remote Similarity NPD5737 Approved
0.6696 Remote Similarity NPD6672 Approved
0.6696 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6695 Remote Similarity NPD6648 Approved
0.6694 Remote Similarity NPD4767 Approved
0.6694 Remote Similarity NPD4768 Approved
0.6667 Remote Similarity NPD4754 Approved
0.6667 Remote Similarity NPD5284 Approved
0.6667 Remote Similarity NPD7983 Approved
0.6667 Remote Similarity NPD5281 Approved
0.6641 Remote Similarity NPD7829 Approved
0.6641 Remote Similarity NPD6335 Approved
0.6641 Remote Similarity NPD7830 Approved
0.6638 Remote Similarity NPD4629 Approved
0.6638 Remote Similarity NPD5210 Approved
0.6638 Remote Similarity NPD5695 Phase 3
0.6637 Remote Similarity NPD5764 Clinical (unspecified phase)
0.6637 Remote Similarity NPD6101 Approved
0.6636 Remote Similarity NPD3668 Phase 3
0.6636 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6614 Remote Similarity NPD6274 Approved
0.6614 Remote Similarity NPD6868 Approved
0.6613 Remote Similarity NPD5249 Phase 3
0.6613 Remote Similarity NPD5251 Approved
0.6613 Remote Similarity NPD5247 Approved
0.6613 Remote Similarity NPD5250 Approved
0.6613 Remote Similarity NPD5248 Approved
0.6613 Remote Similarity NPD6371 Approved
0.661 Remote Similarity NPD5696 Approved
0.6609 Remote Similarity NPD5778 Approved
0.6609 Remote Similarity NPD5779 Approved
0.6606 Remote Similarity NPD4752 Clinical (unspecified phase)
0.6593 Remote Similarity NPD5956 Approved
0.6585 Remote Similarity NPD5128 Approved
0.6579 Remote Similarity NPD5785 Approved
0.6577 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6577 Remote Similarity NPD1694 Approved
0.6574 Remote Similarity NPD7525 Registered
0.6562 Remote Similarity NPD6317 Approved
0.656 Remote Similarity NPD5216 Approved
0.656 Remote Similarity NPD5215 Approved
0.656 Remote Similarity NPD5217 Approved
0.6545 Remote Similarity NPD6695 Phase 3
0.6522 Remote Similarity NPD5693 Phase 1
0.6518 Remote Similarity NPD3574 Clinical (unspecified phase)
0.6512 Remote Similarity NPD6314 Approved
0.6512 Remote Similarity NPD6313 Approved
0.6504 Remote Similarity NPD7899 Clinical (unspecified phase)
0.6496 Remote Similarity NPD6845 Suspended
0.6496 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6489 Remote Similarity NPD6921 Approved
0.6489 Remote Similarity NPD6909 Approved
0.6489 Remote Similarity NPD8444 Approved
0.6489 Remote Similarity NPD6908 Approved

Structure

External Identifiers

PubChem CID   44566280
ChEMBL   CHEMBL499755
ZINC  

Physicochemical Properties

Molecular Weight:  586.39
ALogP:  2.715
MLogP:  4.54
XLogP:  5.005
# Rotatable Bonds:  19
Polar Surface Area:  116.45
# H-Bond Aceptor:  7
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  42

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
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