In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2008 | 32 | No |
Popular Name: (5S)-4-(4-allyloxybenzoyl)-5-(4-ethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one (5S)-4-(4-allyloxybenzoyl)-5-(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) | 3.50 | 9.47 | -58.18 | 0 | 7 | -1 | 88 | 436.484 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 7.28 | -26.33 | 1 | 7 | 0 | 85 | 437.492 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 8.26 | -21.18 | 0 | 7 | 0 | 82 | 437.492 | 11 | ↓ |