In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 20 | Yes |
Popular Name: (2S)-2-(2-diethylaminoethylamino)-1-[(2R,6S)-2,6-dimethyl-1-piperidyl]propan-1-one (2S)-2-(2-diethylaminoethylamino…
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) | 2.13 | 6.19 | -39.21 | 2 | 4 | 1 | 37 | 284.468 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 3.87 | -6.78 | 1 | 4 | 0 | 36 | 283.46 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 5.25 | -36.98 | 2 | 4 | 1 | 40 | 284.468 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 7.94 | -112.24 | 3 | 4 | 2 | 41 | 285.476 | 7 | ↓ |