In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 1-[(2R)-2-[[(1R)-1-(5-bromo-2-hydroxy-phenyl)propyl]amino]propyl]pyrrolidin-2-one 1-[(2R)-2-[[(1R)-1-(5-bromo-2-hy…
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) | 2.47 | 6.45 | -35.16 | 3 | 4 | 1 | 57 | 356.284 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 7.2 | -34.52 | 2 | 4 | 0 | 60 | 355.276 | 6 | ↓ |