In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 20 | Yes |
Popular Name: (2S)-4-phenyl-N-[3-(1-piperidyl)propyl]butan-2-amine (2S)-4-phenyl-N-[3-(1-piperidyl)…
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) | 3.96 | 11.47 | -110.63 | 3 | 2 | 2 | 21 | 276.468 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.96 | 10.18 | -34.54 | 2 | 2 | 1 | 16 | 275.46 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.96 | 9.19 | -42.24 | 2 | 2 | 1 | 20 | 275.46 | 8 | ↓ |