COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188244
Chemical Name: (5E)-5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)C(C)(C)C)C)/C1=O

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Molecular Weight: 421.56
Empirical Formula: C24H27N3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.84
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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