COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904402
Chemical Name: (2E)-2-cyano-N-(furan-2-ylmethyl)-3-{3-[3-(morpholin-4-ylsulfonyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCOCC1)c1ccccc1)/C(=O)NCc1ccco1

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Molecular Weight: 543.6
Empirical Formula: C28H25N5O5S

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 3.162
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 138
Number of rings: 5

     

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