COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426247
Chemical Name: 6-{[3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: COC(=O)c1c(NC(=O)C2CC(=C(CC2C(=O)O)C)C)sc2c1CCCC2

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Molecular Weight: 391.49
Empirical Formula: C20H25NO5S

Physical State: Dry powder
Available Amount: 538 mg

Lipinsky:
logP: 5.282
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 3

     

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