In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2006 | 30 | No |
Popular Name: 3-hydroxy-4-(4-isopropoxybenzoyl)-1-(3-methoxypropyl)-5-(4-pyridyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-isopropoxybenzoyl…
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) | 2.14 | 6.96 | -59.57 | 0 | 7 | -1 | 92 | 409.462 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.14 | 6.21 | -16.94 | 1 | 7 | 0 | 89 | 410.47 | 9 | ↓ |