In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 22 | Yes |
Popular Name: 2-tert-butyl-6-(6-cyclopropylpyrimidin-4-yl)-5,7-dihydropyrrolo[3,4-d]pyrimidine 2-tert-butyl-6-(6-cyclopropylpyr…
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) | 2.18 | 9.48 | -7.24 | 0 | 5 | 0 | 55 | 295.39 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 10.14 | -33.53 | 1 | 5 | 1 | 56 | 296.398 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.