In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 21 | Yes |
Popular Name: [2-[4-[(2-methylimidazol-1-yl)methyl]phenyl]phenyl]methanamine [2-[4-[(2-methylimidazol-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) | 2.61 | 9.26 | -91.66 | 4 | 3 | 2 | 47 | 279.387 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 8.53 | -9.04 | 2 | 3 | 0 | 44 | 277.371 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 8.84 | -44.84 | 3 | 3 | 1 | 45 | 278.379 | 4 | ↓ |