COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455806
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-methyl-3-nitrophenyl)carbonyl]hydrazinecarbothioamide
Smiles: COc1cc(CCNC(=S)NNC(=O)c2ccc(c(c2)[N+](=O)[O-])C)ccc1OC

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Molecular Weight: 418.47
Empirical Formula: C19H22N4O5S

Physical State: Dry powder
Available Amount: 595 mg

Lipinsky:
logP: 3.184
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 149
Number of rings: 2

     

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