In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: 2,4-dichloro-6-[[[(1R)-1-(2-methoxyphenyl)ethyl]amino]methyl]phenol 2,4-dichloro-6-[[[(1R)-1-(2-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) | 4.46 | 7.53 | -28.97 | 2 | 3 | 0 | 49 | 326.223 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 6.29 | -39.89 | 1 | 3 | -1 | 44 | 325.215 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.46 | 6.87 | -40.01 | 3 | 3 | 1 | 46 | 327.231 | 5 | ↓ |