In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2006 | 31 | No |
Popular Name: 1-(2-dimethylaminoethyl)-3-hydroxy-4-(4-methoxybenzoyl)-5-(3-nitrophenyl)-5H-pyrrol-2-one 1-(2-dimethylaminoethyl)-3-hydro…
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) | 2.40 | 1.66 | -59.89 | 2 | 9 | 1 | 117 | 426.449 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 1.5 | -68.76 | 1 | 9 | 1 | 113 | 426.449 | 8 | ↓ |