COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171461
Chemical Name: butyl2-chloro-5-{[(Z)-(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]amino}benzoate
Smiles: CCCCOC(=O)c1cc(N/C=C/2\C(=O)N(C)C(=O)C(=C2C)C#N)ccc1Cl

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Molecular Weight: 401.85
Empirical Formula: C20H20ClN3O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.976
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 2

     

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