In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 34 | No |
Popular Name: 3-hydroxy-1-(3-morpholinopropyl)-4-(4-propoxybenzoyl)-5-(3-pyridyl)-5H-pyrrol-2-one 3-hydroxy-1-(3-morpholinopropyl)…
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) | 2.22 | 8.63 | -58.35 | 2 | 8 | 1 | 93 | 466.558 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 9.31 | -67.8 | 1 | 8 | 1 | 90 | 466.558 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 8.6 | -119.77 | 3 | 8 | 2 | 95 | 467.566 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 9.6 | -122 | 2 | 8 | 2 | 91 | 467.566 | 10 | ↓ |