COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK156917
Chemical Name: (2E,5Z)-5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one
Smiles: Cc1ccc(cc1)/N=C\1/S/C(=C\c2cc(n(c2C)c2cccc(c2)[N+](=O)[O-])C)/C(=O)N1

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Molecular Weight: 432.5
Empirical Formula: C23H20N4O3S

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: 4.373
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 117
Number of rings: 4

     

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