COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK249160
Chemical Name: 1-(4-{2-chloro-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl}piperazin-1-yl)-2-methylpropan-1-one
Smiles: O=C(N1CCN(CC1)c1ccc(cc1Cl)NC1=NS(=O)(=O)c2c1cccc2)C(C)C

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Molecular Weight: 446.96
Empirical Formula: C21H23ClN4O3S

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 3.146
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 4

     

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