In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: N-[3-(1-piperidyl)propyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine N-[3-(1-piperidyl)propyl]-1-(2,2…
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) | 2.65 | 7.38 | -108.06 | 3 | 3 | 2 | 24 | 309.42 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 6.19 | -34.6 | 2 | 3 | 1 | 20 | 308.412 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 5.16 | -42.06 | 2 | 3 | 1 | 23 | 308.412 | 7 | ↓ |