COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK635453
Chemical Name: 1-{4-[(7-chloro-2,1,3-benzoxadiazol-4-yl)sulfonyl]piperazin-1-yl}-3-(3,4-dimethoxyphenyl)propan-1-one
Smiles: COc1cc(CCC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(c3c2non3)Cl)ccc1OC

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Molecular Weight: 494.96
Empirical Formula: C21H23ClN4O6S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.194
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 123
Number of rings: 4

     

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