COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042325
Chemical Name: 4-chloro-N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}benzamide
Smiles: COc1cc(ccc1OC)CCn1c(=O)nc(c2c1NC(=O)C2(NC(=O)c1ccc(cc1)Cl)C(F)(F)F)O

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Molecular Weight: 552.89
Empirical Formula: C24H20ClF3N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.28
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 129
Number of rings: 4

     

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