In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 19 | Yes |
Popular Name: (2R,4R)-2-methyl-1-[(1-methyl-4-piperidyl)methyl]-N-propyl-piperidin-4-amine (2R,4R)-2-methyl-1-[(1-methyl-4-…
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) | 2.53 | 7.36 | -80.24 | 3 | 3 | 2 | 24 | 269.477 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 8.38 | -90.25 | 3 | 3 | 2 | 21 | 269.477 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 9.56 | -174.03 | 4 | 3 | 3 | 25 | 270.485 | 5 | ↓ |