COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK460062
Chemical Name: N-(1,3-benzodioxol-5-yl)-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarbothioamide
Smiles: COc1nn(cc1[N+](=O)[O-])C(C(=O)NNC(=S)Nc1ccc2c(c1)OCO2)C

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Molecular Weight: 408.39
Empirical Formula: C15H16N6O6S

Physical State: Dry powder
Available Amount: 506 mg

Lipinsky:
logP: 1.882
Rotatable bonds: 4
H-donors: 3
H-acceptors: 6
PSA: 176
Number of rings: 3

     

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