In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 19 | Yes |
Popular Name: 2-[(1R)-1-(m-tolylmethylamino)ethyl]benzene-1,4-diol 2-[(1R)-1-(m-tolylmethylamino)et…
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) | 3.32 | 4 | -40.34 | 4 | 3 | 1 | 57 | 258.341 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 2.74 | -10.33 | 3 | 3 | 0 | 52 | 257.333 | 4 | ↓ |