In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: N1-[(3-chloro-4-fluoro-phenyl)methyl]-2-methyl-benzene-1,4-diamine N1-[(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) | 3.42 | 6.31 | -4.86 | 3 | 2 | 0 | 38 | 264.731 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 6.17 | -43.88 | 4 | 2 | 1 | 40 | 265.739 | 3 | ↓ |