In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 25 | Yes |
Popular Name: N-[(1R)-2-methyl-1-(o-tolyl)propyl]-4-oxo-3H-phthalazine-1-carboxamide N-[(1R)-2-methyl-1-(o-tolyl)prop…
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) | 3.72 | 6.68 | -7.11 | 2 | 5 | 0 | 75 | 335.407 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.17 | 4.89 | -45.85 | 1 | 5 | -1 | 78 | 334.399 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.