In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: (2R)-1-(dimethylamino)-3-[(4-ethylcyclohexyl)amino]propan-2-ol (2R)-1-(dimethylamino)-3-[(4-eth…
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) | 1.85 | 4.84 | -100.71 | 4 | 3 | 2 | 41 | 230.396 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 2.32 | -38.3 | 3 | 3 | 1 | 40 | 229.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 5.36 | -40.66 | 3 | 3 | 1 | 44 | 229.388 | 6 | ↓ |