In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2005 | 21 | No |
Popular Name: 3-hydroxy-5-(4-hydroxyphenyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one 3-hydroxy-5-(4-hydroxyphenyl)-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) | 1.55 | -5.2 | -13.24 | 3 | 5 | 0 | 86 | 301.323 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.97 | -5.36 | -18.38 | 2 | 5 | 0 | 83 | 301.323 | 3 | ↓ |