In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 23 | Yes |
Popular Name: 7-[2-(4-tert-butylphenoxy)ethyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine 7-[2-(4-tert-butylphenoxy)ethyl]…
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) | 2.70 | 8.54 | -14.02 | 0 | 5 | 0 | 43 | 314.433 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.70 | 10.84 | -53.76 | 1 | 5 | 1 | 44 | 315.441 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.