UCSF

ZINC01385387

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 20 Yes

Popular Name: 2-chloro-N-[1,2,4]triazolo[1,5-a]pyridin-8-ylbenzenesulfonamide 2-chloro-N-[1,2,4]triazolo[1,5-a…

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CAS Number: 400080-41-3

Other Names:

MFCD01936220

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) 2.11 -3.59 -17.22 1 6 0 76 308.75 3 ↓
Hi High (pH 8-9.5) 2.11 -3.01 -49.44 0 6 -1 78 307.742 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 162 - 164 KeyOrganics

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Rings

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

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