In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2010 | 20 | Yes |
Popular Name: (3R)-1-benzyl-N-[(1S)-1-ethyl-2-methyl-propyl]piperidin-3-amine (3R)-1-benzyl-N-[(1S)-1-ethyl-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) | 3.90 | 10.54 | -112.16 | 3 | 2 | 2 | 21 | 276.468 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 8.32 | -34.98 | 2 | 2 | 1 | 20 | 275.46 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 9.7 | -35.15 | 2 | 2 | 1 | 16 | 275.46 | 6 | ↓ |