In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 22 | Yes |
Popular Name: 1-[(2S)-2-(3-methoxyphenyl)-2-(1-piperidyl)ethyl]piperazine 1-[(2S)-2-(3-methoxyphenyl)-2-(1…
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) | 2.19 | 6.63 | -98.44 | 3 | 4 | 2 | 34 | 305.466 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 5.22 | -31.12 | 2 | 4 | 1 | 29 | 304.458 | 5 | ↓ |