In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: (2S)-1-benzyloxy-3-[[2-(dimethylamino)-2-methyl-propyl]amino]propan-2-ol (2S)-1-benzyloxy-3-[[2-(dimethyl…
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) | 1.52 | 3.43 | -40.12 | 3 | 4 | 1 | 49 | 281.42 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 4.25 | -32.2 | 3 | 4 | 1 | 46 | 281.42 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.52 | 5.54 | -112.64 | 4 | 4 | 2 | 51 | 282.428 | 9 | ↓ |