In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 3-[(3-bromo-4-methoxy-phenyl)methylamino]-1-pyrrolidin-1-yl-propan-1-one 3-[(3-bromo-4-methoxy-phenyl)met…
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) | 2.31 | 6.75 | -51.35 | 2 | 4 | 1 | 46 | 342.257 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 5.39 | -10.36 | 1 | 4 | 0 | 42 | 341.249 | 6 | ↓ |