In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: (3S)-1-benzyl-N-[(1S)-1-methylpropyl]piperidin-3-amine (3S)-1-benzyl-N-[(1S)-1-methylpr…
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) | 3.13 | 9.36 | -109.92 | 3 | 2 | 2 | 21 | 248.414 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 7.14 | -35.08 | 2 | 2 | 1 | 20 | 247.406 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 8.36 | -33.16 | 2 | 2 | 1 | 16 | 247.406 | 5 | ↓ |