In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 4-[(1S)-1-[[(1R)-1-methyl-2-(o-tolyl)ethyl]amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[[(1R)-1-methyl-2-(o-t…
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) | 4.03 | 4.84 | -39.12 | 4 | 3 | 1 | 57 | 286.395 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 4.26 | -6.01 | 3 | 3 | 0 | 52 | 285.387 | 5 | ↓ |