COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK885819
Chemical Name: N-(1,3-benzothiazol-2-yl)-5-cyano-4-(furan-2-yl)-2-methyl-6-[(2-oxo-2-{[2-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C(F)(F)F)NC(=C(C1c1ccco1)C(=O)Nc1nc2c(s1)cccc2)C

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Molecular Weight: 595.63
Empirical Formula: C28H20F3N5O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.026
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 173
Number of rings: 5

     

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