In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2008 | 32 | No |
Popular Name: (5R)-4-(4-allyloxybenzoyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-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) | 3.37 | 8.37 | -58.78 | 0 | 7 | -1 | 88 | 436.484 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 7.01 | -27.84 | 1 | 7 | 0 | 85 | 437.492 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 8.03 | -20.6 | 0 | 7 | 0 | 82 | 437.492 | 11 | ↓ |