COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368154
Chemical Name: (5E)-1-(3,4-dimethylphenyl)-2-thioxo-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]dihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/c1cc(n(c1C)C)C)c1ccc(c(c1)C)C

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Molecular Weight: 367.47
Empirical Formula: C20H21N3O2S

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 4.088
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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