In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: 3-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]-5-fluoro-4-methyl-benzonitrile 3-[(3,5-dichloro-2-hydroxy-pheny…
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) | 4.41 | 6.55 | -6.81 | 2 | 3 | 0 | 56 | 325.17 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.41 | 7.3 | -31.09 | 1 | 3 | -1 | 59 | 324.162 | 3 | ↓ |