COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086422
Chemical Name: (5Z)-5-{[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylidene}-1-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=S)NC(=O)/C(=C/c2cccn2c2ccc(cc2)Cl)/C1=O

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Molecular Weight: 425.87
Empirical Formula: C21H13ClFN3O2S

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 4.765
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 4

     

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