In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: N-[(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)methyl]propan-1-amine 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) | 1.05 | 7.96 | -54.55 | 2 | 5 | 1 | 60 | 220.3 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 6.74 | -15.86 | 1 | 5 | 0 | 55 | 219.292 | 4 | ↓ |