In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 15 | Yes |
Popular Name: N-[(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)methyl]ethanamine N-[(5,7-dimethyl-[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) | 0.54 | 7.21 | -53.84 | 2 | 5 | 1 | 60 | 206.273 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 5.98 | -16.03 | 1 | 5 | 0 | 55 | 205.265 | 3 | ↓ |