In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 1-(2-bromophenyl)-N-[(4-chloro-3-fluoro-phenyl)methyl]methanamine 1-(2-bromophenyl)-N-[(4-chloro-3…
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) | 4.43 | 9.37 | -46.2 | 2 | 1 | 1 | 17 | 329.62 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 7.99 | -4.4 | 1 | 1 | 0 | 12 | 328.612 | 4 | ↓ |