In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 18 | Yes |
Popular Name: (1R)-1-(4-bromophenyl)-2-(2-chloro-6-fluoro-phenyl)ethanamine (1R)-1-(4-bromophenyl)-2-(2-chlo…
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) | 2.79 | 8.26 | -41.55 | 3 | 1 | 1 | 28 | 329.62 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 8.03 | -3.18 | 2 | 1 | 0 | 26 | 328.612 | 3 | ↓ |