In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 29 | No |
Popular Name: 2-[[4-(4-methylpiperazine-1-carbonyl)phenyl]methylsulfonyl]-N-phenyl-acetamide 2-[[4-(4-methylpiperazine-1-carb…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.97 | 6.91 | -69.91 | 2 | 7 | 1 | 88 | 416.523 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 4.56 | -33.41 | 1 | 7 | 0 | 87 | 415.515 | 6 | ↓ |