In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-1-[(4-imidazol-1-ylphenyl)methylamino]propan-2-ol (2S)-1-[(4-imidazol-1-ylphenyl)m…
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) | 0.56 | 5.15 | -50.04 | 3 | 4 | 1 | 55 | 232.307 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.56 | 3.78 | -7.79 | 2 | 4 | 0 | 50 | 231.299 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 5.66 | -84.84 | 4 | 4 | 2 | 56 | 233.315 | 5 | ↓ |