COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK707305
Chemical Name: (2Z)-2-cyano-N-(furan-2-ylmethyl)-3-{1-phenyl-3-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}prop-2-enamide
Smiles: N#C/C(=C/c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCC1)c1ccccc1)/C(=O)NCc1ccco1

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Molecular Weight: 527.6
Empirical Formula: C28H25N5O4S

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 3.884
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 5

     

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