In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 29 | Yes |
Popular Name: N-(2-dimethylaminoethyl)-2-(3-ethyl-4-oxo-phthalazin-1-yl)-N-(3-pyridylmethyl)acetamide N-(2-dimethylaminoethyl)-2-(3-et…
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) | 1.59 | 1.52 | -74.12 | 1 | 7 | 1 | 73 | 394.499 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 1.63 | -129.82 | 2 | 7 | 2 | 74 | 395.507 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.