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Drug Details

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Name:CHEMBL307962
PubChem ID:44311181
Pathway:Show KEGG pathways
InChI:InChI=1S/C51H68N8O9/c1-8-30(5)44(41(61)28-54-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)58-50(67)45(31(6)9-2)59-49(66)40(26-42(62)63)56-48(65)39(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,64)(H,55,60)(H,56,65)(H,57,68)(H,58,67)(H,59,66)(H,62,63)/t30?,31?,37?,39?,40?,44?,45?,46-/m0/s1
SMILES:CCC(C(C(=O)NC(C(=O)CNC(=O)C(Cc1c[nH]c2c1cccc2)N)C(CC)C)NC(=O)C(NC(=O)C(NC(=O)[C@H](C(c1ccccc1)c1ccccc1)NC(=O)C)CC(C)C)CC(=O)O)C

Properties:
Formula:C51H68N8O9Atoms:68
Molecular Weight:937.134Rotatable Bonds:32
H-bond Acceptors:16H-bond Donors:9
logP:6.6577
Targets:
Synonyms:
CHEBI:213165
CHEMBL307962