COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK758878
Chemical Name: 5-acetyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-methyl-4-propyl-1,4-dihydropyridine-3-carbonitrile
Smiles: CCCC1C(=C(SCC(=O)c2ccc(cc2)Br)NC(=C1C(=O)C)C)C#N

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Molecular Weight: 433.37
Empirical Formula: C20H21BrN2O2S

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 4.276
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 2

     

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