In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 31 | No |
Popular Name: (2S)-4-hydroxy-3-(2-methoxybenzoyl)-1-(2-morpholinoethyl)-2-(4-pyridyl)-2H-pyrrol-5-one (2S)-4-hydroxy-3-(2-methoxybenzo…
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) | 0.97 | 5.26 | -64.05 | 0 | 8 | -1 | 95 | 422.461 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 7.53 | -73.17 | 1 | 8 | 0 | 96 | 423.469 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.97 | 6.79 | -53.56 | 2 | 8 | 1 | 93 | 424.477 | 7 | ↓ |