In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 17 | Yes |
Popular Name: (2R)-2-(2-isopropylimidazol-1-yl)-2-phenyl-ethanamine (2R)-2-(2-isopropylimidazol-1-yl…
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) | 1.53 | 6.72 | -101.41 | 4 | 3 | 2 | 47 | 231.343 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 5.76 | -6.71 | 2 | 3 | 0 | 44 | 229.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 6.11 | -53.45 | 3 | 3 | 1 | 45 | 230.335 | 4 | ↓ |