COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043255
Chemical Name: 3-cyano-5-[(2-methoxyphenyl)carbamoyl]-6-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-2-thiolate
Smiles: N#CC1=C([S-])NC(=C(C1c1cccs1)C(=O)Nc1ccccc1OC)C

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Saltdata: CH3(cyClo-(N+(CH2)2O(CH2)2)
Molecular Weight: 382.49
Empirical Formula: C19H16N3O2S2

Physical State: Dry powder
Available Amount: 294 mg

Lipinsky:
logP: 3.545
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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