COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK715982
Chemical Name: methyl4-{[(1Z)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-en-1-yl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)N/C=C(\C(=O)NC1CCCCC1)/C#N

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Molecular Weight: 327.38
Empirical Formula: C18H21N3O3

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 2.472
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 2

     

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