UCSF

ZINC01385370

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 12 No

Popular Name: 8-nitro[1,2,4]triazolo[1,5-a]pyridine 8-nitro[1,2,4]triazolo[1,5-a]pyr…

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CAS Number: 31040-18-3

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 0.68 5.68 -17.07 0 6 0 76 164.124 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 207 - 209 KeyOrganics

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Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.