In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2011 | 20 | Yes |
Popular Name: 1-(3-chloro-4-fluoro-phenyl)-N-[(3,4,5-trifluorophenyl)methyl]methanamine 1-(3-chloro-4-fluoro-phenyl)-N-[…
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) | 4.01 | 8.99 | -68.32 | 2 | 1 | 1 | 17 | 304.694 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.01 | 7.64 | -9.2 | 1 | 1 | 0 | 12 | 303.686 | 4 | ↓ |