In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 21st, 2006 | 9 | Yes |
Popular Name: 3H-[1,2,3]Triazolo[4,5-b]pyridine 3H-[1,2,3]Triazolo[4,5-b]pyridine
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CAS Number: 273-34-7
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) | 0.39 | 1.06 | -42.28 | 0 | 4 | -1 | 53 | 119.107 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.39 | 1.07 | -10.28 | 1 | 4 | 0 | 54 | 120.115 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 207 | TCI |
PUBCHEM_PATENT_ID | EP0366085B1; EP0785939A1; EP0862573A1; EP0906115A1; EP0975222A1; US4914206; US5034404; US5084459; US5175301; US5214152; US5230893; US5256679; US5389641; US5438065; US5489603; US5633375; US5977132; US5994355; US5998433; US6004954; US6008363; US6015789; US6 | IBM Patent Data |
PUBCHEM_PATENT_ID | EP0534323B1; EP0670514A2; EP0670514A3; US5178997; US5389509; US5411851; US5558982; WO1999055726A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.