In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2007 | 26 | No |
Popular Name: 4-[(4-bromophenyl)-hydroxy-methylene]-1-methyl-5-(2-nitrophenyl)-pyrrolidine-2,3-dione 4-[(4-bromophenyl)-hydroxy-methy…
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) | 3.10 | 8.64 | -51.57 | 0 | 7 | -1 | 106 | 416.207 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.10 | 7.61 | -13.75 | 1 | 7 | 0 | 103 | 417.215 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.51 | -0.76 | -12 | 0 | 7 | 0 | 100 | 417.215 | 4 | ↓ |