COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053970
Chemical Name: 1-[(4-methylphenyl)sulfonyl]-N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(prop-2-en-1-ylamino)butan-2-yl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)NCC=C)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 453.63
Empirical Formula: C21H31N3O4S2

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 2.574
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 2

     

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