UCSF

ZINC01393542

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 20 No

Popular Name: 2-(4-Nitro-phenyl)-imidazo[1,2-a]pyridine-3-carboxaldehyde 2-(4-Nitro-phenyl)-imidazo[1,2-a…

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CAS Number: 817172-44-4

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) 2.96 2.04 -14.39 0 6 0 80 267.244 3 ↓
Mid Mid (pH 6-8) 2.96 2.21 -41.82 1 6 1 81 268.252 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 264 - 265 KeyOrganics

Activity (Go SEA)

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

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