COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531102
Chemical Name: N-(3-chlorophenyl)-4-({[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}methyl)piperidine-1-carbothioamide
Smiles: Clc1cccc(c1)NC(=S)N1CCC(CC1)CNC=C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 434
Empirical Formula: C22H28ClN3O2S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.883
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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