In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 4-[[[(1S)-1-methyl-2-(o-tolyl)ethyl]amino]methyl]benzene-1,3-diol 4-[[[(1S)-1-methyl-2-(o-tolyl)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) | 3.47 | 4.39 | -38.99 | 4 | 3 | 1 | 57 | 272.368 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.47 | 3.18 | -5.88 | 3 | 3 | 0 | 52 | 271.36 | 5 | ↓ |