In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: [1-[[2-(aminomethyl)phenyl]methylsulfonyl]-4-piperidyl]methanol [1-[[2-(aminomethyl)phenyl]methy…
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) | 0.59 | 0.53 | -56.2 | 4 | 5 | 1 | 85 | 299.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.59 | 1.1 | -10.87 | 3 | 5 | 0 | 84 | 298.408 | 5 | ↓ |