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Name:CHEMBL384836
PubChem ID:44280339
Pathway:Show KEGG pathways
InChI:InChI=1S/C50H67N11O11S2/c1-27(62)41(43(53)65)59-49(71)40-26-74-73-25-39(58-44(66)34(52)21-30-16-18-32(64)19-17-30)48(70)56-37(22-29-11-5-4-6-12-29)46(68)57-38(23-31-24-54-35-14-8-7-13-33(31)35)47(69)55-36(15-9-10-20-51)45(67)60-42(28(2)63)50(72)61(40)3/h4-8,11-14,16-19,24,27-28,34,36-42,54,62-64H,9-10,15,20-23,25-26,51-52H2,1-3H3,(H2,53,65)(H,55,69)(H,56,70)(H,57,68)(H,58,66)(H,59,71)(H,60,67)/t27-,28-,34-,36+,37+,38+,39-,40+,41+,42?/m1/s1
SMILES:NCCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](N(C(=O)[C@@H](NC1=O)[C@H](O)C)C)C(=O)N[C@H](C(=O)N)[C@H](O)C)NC(=O)[C@@H](Cc1ccc(cc1)O)N)Cc1c[nH]c2c1cccc2

Properties:
Formula:C50H67N11O11S2Atoms:74
Molecular Weight:1062.26Rotatable Bonds:19
H-bond Acceptors:23H-bond Donors:13
logP:2.8712
Targets:
Synonyms:
CHEBI:144587
CHEMBL384836