COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK785890
Chemical Name: dimethyl6'-amino-1'-(3-chloro-4-fluorophenyl)-5'-cyano-1',4'-dihydro-3,4'-bipyridine-2',3'-dicarboxylate
Smiles: COC(=O)C1=C(C(=O)OC)C(C(=C(N1c1ccc(c(c1)Cl)F)N)C#N)c1cccnc1

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Molecular Weight: 442.83
Empirical Formula: C21H16ClFN4O4

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 1.462
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 118
Number of rings: 3

     

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