In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 32 | No |
Popular Name: (5S)-3-hydroxy-4-(4-methoxy-2-methyl-benzoyl)-1-(2-morpholinoethyl)-5-phenyl-5H-pyrrol-2-one (5S)-3-hydroxy-4-(4-methoxy-2-me…
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) | 2.69 | 7.54 | -59.51 | 0 | 7 | -1 | 82 | 435.5 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 9.2 | -51.28 | 2 | 7 | 1 | 81 | 437.516 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 9.87 | -73.77 | 1 | 7 | 0 | 83 | 436.508 | 7 | ↓ |