In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 18 | Yes |
Popular Name: [2-(4-chloro-3,5-dimethyl-phenoxy)-3-pyridyl]methanamine [2-(4-chloro-3,5-dimethyl-phenox…
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) | 3.36 | 4.51 | -45.93 | 3 | 3 | 1 | 50 | 263.748 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.36 | 4.1 | -6.58 | 2 | 3 | 0 | 48 | 262.74 | 3 | ↓ |