COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL390305
Chemical Name: 2-({4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)-N-(2-phenylethyl)hydrazinecarbothioamide
Smiles: S=C(NNC(=O)c1ccc(cc1)Cn1nc(c(c1C)[N+](=O)[O-])C)NCCc1ccccc1

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Molecular Weight: 452.54
Empirical Formula: C22H24N6O3S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 3.831
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 148
Number of rings: 3

     

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