COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323440
Chemical Name: methyl5-cyano-2-methyl-6-sulfanyl-4-(thiophen-3-yl)-1,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1cscc1)C#N)S

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Saltdata: cyClo-{NH(CH2)2O(CH2)2}
Molecular Weight: 292.38
Empirical Formula: C13H12N2O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.091
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 129
Number of rings: 2

     

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