COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323726
Chemical Name: prop-2-en-1-yl5'-cyano-2'-methyl-6'-sulfanyl-1',4'-dihydro-3,4'-bipyridine-3'-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccnc1)C#N)S

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Saltdata: cyClo-{NH(CH2)2O(CH2)2}
Molecular Weight: 313.38
Empirical Formula: C16H15N3O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.674
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 113
Number of rings: 2

     

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