In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 17 | Yes |
Popular Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-1-(1-methylimidazol-2-yl)methanamine N-[(2-chloro-4-fluoro-phenyl)met…
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) | 1.83 | 6.22 | -31.83 | 2 | 3 | 1 | 31 | 254.716 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 5.75 | -10.55 | 1 | 3 | 0 | 30 | 253.708 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 7.15 | -47.97 | 2 | 3 | 1 | 34 | 254.716 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 7.6 | -112.34 | 3 | 3 | 2 | 36 | 255.724 | 4 | ↓ |