In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2011 | 21 | Yes |
Popular Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-1-(1-methylbenzimidazol-2-yl)methanamine N-[(3-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) | 3.33 | 7.82 | -13.27 | 1 | 3 | 0 | 30 | 303.768 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 8.26 | -34.01 | 2 | 3 | 1 | 31 | 304.776 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 9.18 | -59.77 | 2 | 3 | 1 | 34 | 304.776 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 9.6 | -128.94 | 3 | 3 | 2 | 36 | 305.784 | 4 | ↓ |