COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL101579
Chemical Name: N-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-N-(2-methoxy-5-nitrophenyl)methanesulfonamide
Smiles: COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

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Molecular Weight: 506.54
Empirical Formula: C22H26N4O8S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 1.57
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 142
Number of rings: 4

     

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