COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398516
Chemical Name: propan-2-yl2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc2c1CCCCC2)C

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Molecular Weight: 401.48
Empirical Formula: C21H23NO5S

Physical State: Dry powder
Available Amount: 483 mg

Lipinsky:
logP: 6.571
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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