In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 21 | Yes |
Popular Name: (1R,2R)-1-(2-chloro-5-methyl-phenoxy)-1-(4-fluorophenyl)butan-2-amine (1R,2R)-1-(2-chloro-5-methyl-phe…
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) | 4.54 | 8.65 | -46.69 | 3 | 2 | 1 | 37 | 308.804 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.54 | 8.44 | -4.07 | 2 | 2 | 0 | 35 | 307.796 | 5 | ↓ |