In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 29 | No |
Popular Name: (5R)-4-(4-allyloxybenzoyl)-1-(2-dimethylaminoethyl)-5-(2-furyl)-3-hydroxy-5H-pyrrol-2-one (5R)-4-(4-allyloxybenzoyl)-1-(2-…
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) | 2.37 | 8.39 | -72.76 | 1 | 7 | 0 | 87 | 396.443 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 5.86 | -58.67 | 0 | 7 | -1 | 86 | 395.435 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 7.57 | -51.61 | 2 | 7 | 1 | 84 | 397.451 | 9 | ↓ |