In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: 4-[[[(S)-cyclopropyl(phenyl)methyl]amino]methyl]benzene-1,3-diol 4-[[[(S)-cyclopropyl(phenyl)meth…
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) | 3.39 | 4.7 | -40.79 | 4 | 3 | 1 | 57 | 270.352 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.39 | 5.45 | -34.36 | 3 | 3 | 0 | 60 | 269.344 | 5 | ↓ |