In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 17 | Yes |
Popular Name: (1S)-2-imidazol-1-yl-1-(4-isopropylphenyl)ethanamine (1S)-2-imidazol-1-yl-1-(4-isopro…
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) | 0.62 | 7.53 | -52.21 | 3 | 3 | 1 | 45 | 230.335 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 7.2 | -6.65 | 2 | 3 | 0 | 44 | 229.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 8.01 | -117.5 | 4 | 3 | 2 | 47 | 231.343 | 4 | ↓ |