COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053912
Chemical Name: N-(1,1-dioxidotetrahydrothiophen-3-yl)-1-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-prolinamide
Smiles: O=C([C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)NC1CCS(=O)(=O)C1

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Molecular Weight: 497.64
Empirical Formula: C22H31N3O6S2

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: -0.037
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 137
Number of rings: 4

     

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