In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 28 | No |
Popular Name: (5S)-4-(4-bromobenzoyl)-1-(3-dimethylaminopropyl)-3-hydroxy-5-(3-pyridyl)-5H-pyrrol-2-one (5S)-4-(4-bromobenzoyl)-1-(3-dim…
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) | 2.25 | 8.94 | -69.93 | 1 | 6 | 0 | 78 | 444.329 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.25 | 8.12 | -46.84 | 2 | 6 | 1 | 75 | 445.337 | 7 | ↓ |