COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK730776
Chemical Name: (2E)-3-(4-chlorophenyl)-N-({2-[(3,4,5-trimethoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)prop-2-enamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NNC(=S)NC(=O)/C=C/c1ccc(cc1)Cl

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Molecular Weight: 449.91
Empirical Formula: C20H20ClN3O5S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.947
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 130
Number of rings: 2

     

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