In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 13 | Yes |
Popular Name: (2S)-1-(dimethylamino)-3-(1,1-dimethylpropylamino)propan-2-ol (2S)-1-(dimethylamino)-3-(1,1-di…
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) | 1.17 | 2.63 | -95.46 | 4 | 3 | 2 | 41 | 190.331 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.17 | 0.09 | -34.58 | 3 | 3 | 1 | 40 | 189.323 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.17 | 3.18 | -38.58 | 3 | 3 | 1 | 44 | 189.323 | 6 | ↓ |