In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 19 | Yes |
Popular Name: (2R)-2-[2-(aminomethyl)-4-bromo-phenoxy]-1-pyrrolidin-1-yl-propan-1-one (2R)-2-[2-(aminomethyl)-4-bromo-…
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) | 2.03 | 5.65 | -41.02 | 3 | 4 | 1 | 57 | 328.23 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 5.24 | -10.39 | 2 | 4 | 0 | 56 | 327.222 | 4 | ↓ |