In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 17 | Yes |
Popular Name: [2-[(2-isopropylimidazol-1-yl)methyl]phenyl]methanamine [2-[(2-isopropylimidazol-1-yl)me…
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) | 1.87 | 6.55 | -101.56 | 4 | 3 | 2 | 47 | 231.343 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 5.7 | -7.96 | 2 | 3 | 0 | 44 | 229.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 6.1 | -56.92 | 3 | 3 | 1 | 45 | 230.335 | 4 | ↓ |