In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 35 | No |
Popular Name: (2R)-3-(4-butoxybenzoyl)-2-(3,4-diethoxyphenyl)-4-hydroxy-1-(2-hydroxyethyl)-2H-pyrrol-5-one (2R)-3-(4-butoxybenzoyl)-2-(3,4-…
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) | 3.64 | 8.19 | -59.78 | 1 | 8 | -1 | 108 | 482.553 | 13 | ↓ |
Lo Low (pH 4.5-6) | 3.64 | 7.44 | -14.92 | 2 | 8 | 0 | 106 | 483.561 | 13 | ↓ |