In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 26 | No |
Popular Name: (5S)-1-(3-dimethylaminopropyl)-4-(furan-2-carbonyl)-3-hydroxy-5-(4-pyridyl)-5H-pyrrol-2-one (5S)-1-(3-dimethylaminopropyl)-4…
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) | 0.65 | 6.7 | -72.13 | 1 | 7 | 0 | 91 | 355.394 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 7.14 | -114.64 | 2 | 7 | 1 | 92 | 356.402 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 6.32 | -108.62 | 3 | 7 | 2 | 89 | 357.41 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 5.89 | -47.34 | 2 | 7 | 1 | 88 | 356.402 | 7 | ↓ |