In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 19 | Yes |
Popular Name: 4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]butan-1-ol 4-[[(2S)-2-(dimethylamino)-2-(3-…
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) | 1.30 | 2.32 | -42.61 | 3 | 4 | 1 | 49 | 267.393 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.30 | 4.59 | -116.05 | 4 | 4 | 2 | 51 | 268.401 | 9 | ↓ |