COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL403987
Chemical Name: (5Z)-3-cyclohexyl-5-{4-methoxy-3-[(3-nitro-1H-pyrazol-1-yl)methyl]benzylidene}-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1Cn1ccc(n1)[N+](=O)[O-])/C=C/1\N=C(N(C1=O)C1CCCCC1)S

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Molecular Weight: 441.51
Empirical Formula: C21H23N5O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.936
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 144
Number of rings: 4

     

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