In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(ethylamino)-3-[(1-ethyl-4-piperidyl)-methyl-amino]propan-1-ol (2S)-2-cyclopropyl-2-(ethylamino…
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) | 1.60 | 4.81 | -80.61 | 4 | 4 | 2 | 45 | 285.476 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 5.4 | -31.77 | 3 | 4 | 1 | 40 | 284.468 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.60 | 6.8 | -186.72 | 5 | 4 | 3 | 46 | 286.484 | 8 | ↓ |