In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | Yes |
Popular Name: N7-[(3-chloro-4-fluoro-phenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6,7-diamine N7-[(3-chloro-4-fluoro-phenyl)me…
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) | 2.88 | 4.83 | -48.27 | 4 | 4 | 1 | 58 | 309.748 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 4.94 | -8.26 | 3 | 4 | 0 | 57 | 308.74 | 3 | ↓ |