COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564812
Chemical Name: N-[(3-{2-[(1S,5S,8aR)-5-(methoxycarbonyl)-5,8a-dimethyl-2-methylidenedecahydronaphthalen-1-yl]ethyl}furan-2-yl)methyl]methionine
Smiles: CSCCC(C(=O)O)NCc1occc1CC[C@H]1C(=C)CCC2[C@]1(C)CCC[C@]2(C)C(=O)OC

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Molecular Weight: 491.69
Empirical Formula: C27H41NO5S

Physical State: Liquid
Available Amount: 68 mg

Lipinsky:
logP: 7.159
Rotatable bonds: 11
H-donors: 2
H-acceptors: 5
PSA: 114
Number of rings: 3

     

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