In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: (2R)-2-(2-diethylaminoethylamino)-2-(3,5-dimethylphenyl)ethanol (2R)-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) | 2.66 | 4.61 | -36.99 | 3 | 3 | 1 | 40 | 265.421 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 3.57 | -3.58 | 2 | 3 | 0 | 35 | 264.413 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 5.66 | -34.53 | 3 | 3 | 1 | 37 | 265.421 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.66 | 6.75 | -113.02 | 4 | 3 | 2 | 41 | 266.429 | 8 | ↓ |