| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: (1S)-2-[[2-(dimethylamino)-2-methyl-propyl]amino]-1-(4-fluorophenyl)ethanol (1S)-2-[[2-(dimethylamino)-2-met…
| 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) | 1.56 | 3.33 | -42.89 | 3 | 3 | 1 | 40 | 255.357 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 2.06 | -3.85 | 2 | 3 | 0 | 35 | 254.349 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.56 | 4.18 | -35.75 | 3 | 3 | 1 | 37 | 255.357 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.56 | 5.43 | -119.72 | 4 | 3 | 2 | 41 | 256.365 | 6 | ↓ |
