In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 20 | Yes |
Popular Name: N-[(1R)-1-(3,4-dimethylphenyl)ethyl]-1-isopropyl-piperidin-4-amine N-[(1R)-1-(3,4-dimethylphenyl)et…
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) | 3.97 | 9.58 | -32.08 | 2 | 2 | 1 | 16 | 275.46 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.97 | 10.65 | -105.85 | 3 | 2 | 2 | 21 | 276.468 | 4 | ↓ |