COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK425320
Chemical Name: 6-{[6-ethyl-3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)C1CC(=C(CC1C(=O)O)C)C

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Molecular Weight: 419.54
Empirical Formula: C22H29NO5S

Physical State: Dry powder
Available Amount: 885 mg

Lipinsky:
logP: 6.305
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 3

     

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