COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473410
Chemical Name: 4-[(1E)-2-cyano-3-(cycloheptylamino)-3-oxoprop-1-en-1-yl]-2-methoxyphenyl3-methylbenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1cccc(c1)C)/C(=O)NC1CCCCCC1

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Molecular Weight: 432.52
Empirical Formula: C26H28N2O4

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 5.545
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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