In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-2-[(2-hydroxy-3-methoxy-phenyl)methylamino]-1-(1-piperidyl)propan-1-one (2S)-2-[(2-hydroxy-3-methoxy-phe…
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) | 1.63 | 3.17 | -12.9 | 2 | 5 | 0 | 62 | 292.379 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.63 | 5.32 | -39.91 | 2 | 5 | 0 | 69 | 292.379 | 5 | ↓ |