COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK968353
Chemical Name: propan-2-yl5'-cyano-2'-methyl-6'-sulfanyl-1',4'-dihydro-3,4'-bipyridine-3'-carboxylate
Smiles: N#CC1=C(S)NC(=C(C1c1cccnc1)C(=O)OC(C)C)C

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Saltdata: 1,4-thetrahydrothiazine
Molecular Weight: 315.4
Empirical Formula: C16H17N3O2S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 1.8
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 113
Number of rings: 2

     

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