COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK129156
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)sulfonyl]piperazine
Smiles: [O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Saltdata: HCl
Molecular Weight: 405.43
Empirical Formula: C18H19N3O6S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 3.153
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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