COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK439001
Chemical Name: ethyl2-{[(4-benzylpiperidin-1-yl)carbonothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2CCC(CC2)Cc2ccccc2)sc2c1CCCCC2

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Molecular Weight: 456.67
Empirical Formula: C25H32N2O2S2

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 8.226
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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