In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 20 | Yes |
Popular Name: N-[(1R)-1-(1,3,5-trimethylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine N-[(1R)-1-(1,3,5-trimethylpyrazo…
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) | 2.06 | 7.09 | -10.85 | 1 | 5 | 0 | 56 | 287.392 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 7.22 | -34.41 | 2 | 5 | 1 | 57 | 288.4 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 7.54 | -33.6 | 2 | 5 | 1 | 57 | 288.4 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.