In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 20 | Yes |
Popular Name: (1R)-N-benzyl-1-(3-bromo-4-fluoro-phenyl)-N-methyl-ethane-1,2-diamine (1R)-N-benzyl-1-(3-bromo-4-fluor…
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) | 3.03 | 6.69 | -59.19 | 3 | 2 | 1 | 31 | 338.244 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.03 | 8.65 | -143.84 | 4 | 2 | 2 | 32 | 339.252 | 5 | ↓ |