In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: 1-[(2R)-2-(ethylamino)-2-(o-tolyl)ethyl]-N,N-dimethyl-piperidin-4-amine 1-[(2R)-2-(ethylamino)-2-(o-toly…
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) | 2.91 | 8.55 | -86.12 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 6.6 | -35.54 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 6.85 | -33.33 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 9.22 | -100.79 | 3 | 3 | 2 | 21 | 291.483 | 6 | ↓ |