In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 27 | No |
Popular Name: (5S)-3-hydroxy-1-(2-hydroxyethyl)-5-(3-methoxyphenyl)-4-(4-methylbenzoyl)-5H-pyrrol-2-one (5S)-3-hydroxy-1-(2-hydroxyethyl…
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) | 2.23 | 5.13 | -64.69 | 1 | 6 | -1 | 90 | 366.393 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 4.18 | -29.46 | 2 | 6 | 0 | 87 | 367.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 5.17 | -21.04 | 1 | 6 | 0 | 84 | 367.401 | 6 | ↓ |