In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 23 | Yes |
Popular Name: 5-methyl-4-[[(1R)-1-(3-methyl-2-pyridyl)ethyl]amino]thieno[2,3-d]pyrimidine-6-carboxylic 5-methyl-4-[[(1R)-1-(3-methyl-2-…
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) | 3.04 | 8.82 | -49.61 | 1 | 6 | -1 | 91 | 327.389 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.04 | 9.35 | -61.66 | 2 | 6 | 0 | 92 | 328.397 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.