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Drug Details

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Name:CHEMBL599872
PubChem ID:46228924
Pathway:Show KEGG pathways
InChI:InChI=1S/C38H53N5O9S/c1-7-25-18-38(25,33(46)41-53(49,50)27-14-15-27)40-31(44)29-17-26-20-43(29)32(45)30(36(2,3)4)39-34(47)51-22-37(5,6)16-9-8-11-23-12-10-13-24-19-42(21-28(23)24)35(48)52-26/h7,10,12-13,25-27,29-30H,1,8-9,11,14-22H2,2-6H3,(H,39,47)(H,40,44)(H,41,46)/t25-,26?,29+,30?,38-/m1/s1
SMILES:C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H]2CN1C(=O)[C@@H](NC(=O)OCC(C)(C)CCCCc1c3CN(C(=O)O2)Cc3ccc1)C(C)(C)C)C(=O)NS(=O)(=O)C1CC1

Properties:
Formula:C38H53N5O9SAtoms:53
Molecular Weight:755.921Rotatable Bonds:9
H-bond Acceptors:14H-bond Donors:3
logP:5.7383
Targets:
Synonyms:
CHEBI:697302
CHEMBL599872