COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886214
Chemical Name: ethyl5-cyano-6-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1cc(Cl)cc(c1)Cl)c1ccccc1

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Molecular Weight: 554.45
Empirical Formula: C27H21Cl2N3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.283
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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