In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 18 | Yes |
Popular Name: 1-[(1S)-1,5-dimethylhexyl]-N-propyl-piperidin-4-amine 1-[(1S)-1,5-dimethylhexyl]-N-pro…
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) | 4.16 | 7.98 | -35.65 | 2 | 2 | 1 | 20 | 255.47 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.16 | 8.66 | -31.3 | 2 | 2 | 1 | 16 | 255.47 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.16 | 9.86 | -102.45 | 3 | 2 | 2 | 21 | 256.478 | 8 | ↓ |