In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: (2R)-2-(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)pentan-2-amine (2R)-2-(5,7-dimethyl-[1,2,4]tria…
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) | 1.86 | 7.1 | -58.57 | 3 | 5 | 1 | 71 | 234.327 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 6.89 | -17.57 | 2 | 5 | 0 | 69 | 233.319 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.