In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 20 | Yes |
Popular Name: 1-[(1R,2R)-2-amino-1-(4-chlorophenyl)propyl]-N,N-dimethyl-piperidin-4-amine 1-[(1R,2R)-2-amino-1-(4-chloroph…
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) | 2.23 | 5.69 | -124.18 | 4 | 3 | 2 | 35 | 297.874 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 6.91 | -93.29 | 4 | 3 | 2 | 35 | 297.874 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 4.2 | -45.37 | 3 | 3 | 1 | 34 | 296.866 | 4 | ↓ |