In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 36 | No |
Popular Name: 4-[(4-benzyloxyphenyl)-hydroxy-methylene]-5-phenyl-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 4-[(4-benzyloxyphenyl)-hydroxy-m…
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) | 4.19 | 13.17 | -62.86 | 0 | 6 | -1 | 83 | 475.524 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.64 | 11.88 | -17.57 | 1 | 6 | 0 | 80 | 476.532 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.64 | 12.16 | -42.98 | 2 | 6 | 1 | 81 | 477.54 | 7 | ↓ |