In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (2R)-1-[(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-3-(propylamino)propan-2-ol (2R)-1-[(2S,5S)-5-ethyl-2-methyl…
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) | 1.09 | 1.69 | -41.09 | 3 | 4 | 1 | 49 | 245.387 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.09 | 0.29 | -2.89 | 2 | 4 | 0 | 45 | 244.379 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 3.59 | -104.69 | 4 | 4 | 2 | 51 | 246.395 | 7 | ↓ |