COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367388
Chemical Name: (5E)-1-(3-chloro-4-methylphenyl)-5-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)Cl)C)C)/C(=O)N1c1ccc(c(c1)Cl)C

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Molecular Weight: 498.43
Empirical Formula: C25H21Cl2N3O2S

Physical State: Dry powder
Available Amount: 561 mg

Lipinsky:
logP: 7.148
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 4

     

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