In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-2-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]-1-(1-piperidyl)propan-1-one (2S)-2-[(3,5-dichloro-2-hydroxy-…
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) | 3.08 | 4.26 | -10.47 | 2 | 4 | 0 | 53 | 331.243 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 5.01 | -42.82 | 1 | 4 | -1 | 55 | 330.235 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 6.26 | -34.44 | 2 | 4 | 0 | 60 | 331.243 | 4 | ↓ |