In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2008 | 36 | No |
Popular Name: (5R)-4-(4-allyloxybenzoyl)-3-hydroxy-1-(2-methoxyethyl)-5-(3-phenoxyphenyl)-5H-pyrrol-2-one (5R)-4-(4-allyloxybenzoyl)-3-hyd…
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) | 4.79 | 11.78 | -45.16 | 0 | 7 | -1 | 88 | 484.528 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.24 | 9.76 | -28.26 | 1 | 7 | 0 | 85 | 485.536 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.21 | 10.76 | -22.46 | 0 | 7 | 0 | 82 | 485.536 | 11 | ↓ |