In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 30 | Yes |
Popular Name: N-[6-[4-[(2S)-2-hydroxy-3-(1-piperidyl)propyl]piperazin-1-yl]-3-pyridyl]furan-2-carboxamide N-[6-[4-[(2S)-2-hydroxy-3-(1-pip…
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) | 1.64 | 5.41 | -43.28 | 3 | 8 | 1 | 86 | 414.53 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.68 | -112.73 | 4 | 8 | 2 | 87 | 415.538 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 5.76 | -81.97 | 4 | 8 | 2 | 88 | 415.538 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 8.03 | -184.87 | 5 | 8 | 3 | 89 | 416.546 | 7 | ↓ |