In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 17 | Yes |
Popular Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)methanamine N-[(5-bromo-2-fluoro-phenyl)meth…
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) | 1.42 | 7.98 | -51.92 | 2 | 4 | 1 | 47 | 300.155 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 6.62 | -13.56 | 1 | 4 | 0 | 43 | 299.147 | 4 | ↓ |