In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 24 | Yes |
Popular Name: (2-ethyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)-(4-imidazol-1-ylphenyl)methanone (2-ethyl-5,7-dihydropyrrolo[3,4-…
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) | 0.22 | 8.61 | -13.07 | 0 | 6 | 0 | 64 | 319.368 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.22 | 9.13 | -44.86 | 1 | 6 | 1 | 65 | 320.376 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.