In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: (1S)-2-[[2-(dimethylamino)-2-methyl-propyl]amino]-1-(2-methoxy-5-methyl-phenyl)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) | 1.83 | 3.29 | -35.4 | 3 | 4 | 1 | 49 | 281.42 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 4.19 | -30.26 | 3 | 4 | 1 | 46 | 281.42 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.83 | 5.39 | -109.04 | 4 | 4 | 2 | 51 | 282.428 | 7 | ↓ |