COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK161380
Chemical Name: (5E)-5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-thioxoimidazolidin-4-one
Smiles: S=C1NC(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)Cl)Cl)C)/N1

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Molecular Weight: 366.27
Empirical Formula: C16H13Cl2N3OS

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 5.109
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 78
Number of rings: 3

     

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