In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 21 | Yes |
Popular Name: (2S)-3-[4-(1,1-dimethylpropyl)phenoxy]-2-methyl-2-(propylamino)propan-1-ol (2S)-3-[4-(1,1-dimethylpropyl)ph…
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) | 4.49 | 6.28 | -35.51 | 3 | 3 | 1 | 46 | 294.459 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.49 | 5.03 | -3.12 | 2 | 3 | 0 | 41 | 293.451 | 9 | ↓ |