COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183042
Chemical Name: 2-chloro-4-{5-[(1E)-2-cyano-3-(cyclopentylamino)-3-oxoprop-1-en-1-yl]furan-2-yl}benzoicacid
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(c(c1)Cl)C(=O)O)/C(=O)NC1CCCC1

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Molecular Weight: 384.82
Empirical Formula: C20H17ClN2O4

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 3.896
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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