In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 33 | No |
Popular Name: (5R)-4-benzoyl-5-(4-tert-butylphenyl)-3-hydroxy-1-(2-piperazin-1-ylethyl)-5H-pyrrol-2-one (5R)-4-benzoyl-5-(4-tert-butylph…
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) | 3.41 | 8.89 | -86.83 | 2 | 6 | 0 | 80 | 447.579 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.41 | 8.12 | -51.07 | 3 | 6 | 1 | 77 | 448.587 | 7 | ↓ |