In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 20 | Yes |
Popular Name: 4-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]thieno[3,2-d]pyrimidine 4-[3-(3,5-dimethylpyrazol-1-yl)a…
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) | 1.89 | 7.61 | -11.7 | 0 | 5 | 0 | 47 | 285.376 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 8.07 | -32.18 | 1 | 5 | 1 | 48 | 286.384 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 7.73 | -35.97 | 1 | 5 | 1 | 48 | 286.384 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.