COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170740
Chemical Name: butyl5-{[(1Z)-2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-en-1-yl]amino}-2-chlorobenzoate
Smiles: CCCCOC(=O)c1cc(N/C=C(/c2nc3c(o2)cccc3)\C=O)ccc1Cl

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Molecular Weight: 398.85
Empirical Formula: C21H19ClN2O4

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 5.509
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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