COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK108395
Chemical Name: 5-{5-[(1E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-en-1-yl]furan-2-yl}-2-methylbenzoicacid
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(c(c1)C(=O)O)C)/C(=O)NC1CCCCC1

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Molecular Weight: 378.43
Empirical Formula: C22H22N2O4

Physical State: Dry powder
Available Amount: 371 mg

Lipinsky:
logP: 4.892
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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