COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK763277
Chemical Name: methylN-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[(2,4-dichlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)N)CCCC2)NC(=O)c1ccc(cc1Cl)Cl

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Molecular Weight: 524.35
Empirical Formula: C20H18Cl2F3N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.067
Rotatable bonds: 6
H-donors: 4
H-acceptors: 4
PSA: 138
Number of rings: 3

     

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