In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 21 | No |
Popular Name: 2-(2H-2,3,4,5-tetraazolyl)-3-((2-methyl(4-quinolyl))amino)prop-2-enenitrile 2-(2H-2,3,4,5-tetraazolyl)-3-((2…
Find On: PubMed — Wikipedia — Google
CAS Number: 1025599-48-7
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) | 1.19 | 5.07 | -49.84 | 2 | 7 | 0 | 103 | 277.291 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.