In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 20 | Yes |
Popular Name: 2-[1-[(7-methyl-[1,2,4]triazolo[3,4-f]pyrimidin-3-yl)methyl]cyclopentyl]acetic 2-[1-[(7-methyl-[1,2,4]triazolo[…
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) | 1.37 | 9.46 | -58.81 | 0 | 6 | -1 | 83 | 273.316 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.37 | 7.48 | -11.74 | 1 | 6 | 0 | 80 | 274.324 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.