In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: (1R)-1-(4-chlorophenyl)-2-[[2-(dimethylamino)-2-methyl-propyl]amino]ethanol (1R)-1-(4-chlorophenyl)-2-[[2-(d…
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) | 2.08 | 3.79 | -41.82 | 3 | 3 | 1 | 40 | 271.812 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.08 | 2.63 | -3.09 | 2 | 3 | 0 | 35 | 270.804 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 4.75 | -34.37 | 3 | 3 | 1 | 37 | 271.812 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.08 | 5.95 | -118.61 | 4 | 3 | 2 | 41 | 272.82 | 6 | ↓ |