In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 30 | No |
Popular Name: (2R)-4-hydroxy-1-(3-hydroxypropyl)-3-(4-isobutoxybenzoyl)-2-(4-pyridyl)-2H-pyrrol-5-one (2R)-4-hydroxy-1-(3-hydroxypropy…
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) | 1.91 | 5.93 | -57.71 | 1 | 7 | -1 | 103 | 409.462 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.91 | 5.18 | -14.79 | 2 | 7 | 0 | 100 | 410.47 | 9 | ↓ |