COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396975
Chemical Name: (5E)-5-({1-[4-(dimethylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-1-(3,4-dimethylphenyl)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(c2ccccc2)C(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)N(C)C)C)/C(=O)N1c1ccc(c(c1)C)C

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Molecular Weight: 548.71
Empirical Formula: C33H32N4O2S

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 7.582
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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