COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK448270
Chemical Name: ethyl2-[({4-[hydroxy(diphenyl)methyl]piperidin-1-yl}carbonothioyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2CCC(CC2)C(c2ccccc2)(c2ccccc2)O)sc2c1CCCCC2

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Molecular Weight: 548.77
Empirical Formula: C31H36N2O3S2

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 8.554
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 5

     

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