COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457545
Chemical Name: methyl2-({[2-(3,4-dimethoxyphenyl)ethyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COc1ccc(cc1OC)CCNC(=S)Nc1sc2c(c1C(=O)OC)CCCCCC2

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Molecular Weight: 462.63
Empirical Formula: C23H30N2O4S2

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 7.043
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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