COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL395108
Chemical Name: (5Z)-3-butyl-5-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzylidene}-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Smiles: CCCCN1C(=N/C(=C\c2ccc(c(c2)Cn2nc(c(c2C)[N+](=O)[O-])C)OC)/C1=O)S

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Molecular Weight: 443.53
Empirical Formula: C21H25N5O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.764
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 144
Number of rings: 3

     

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