In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 20 | Yes |
Popular Name: (2S)-2-[(2,4-dichlorophenyl)methylamino]-1-(1-piperidyl)propan-1-one (2S)-2-[(2,4-dichlorophenyl)meth…
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) | 3.37 | 8.19 | -43.22 | 2 | 3 | 1 | 37 | 316.252 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.37 | 6.94 | -8.51 | 1 | 3 | 0 | 32 | 315.244 | 4 | ↓ |