UCSF

ZINC49538620

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 52 No

Popular Name: Rifaldehyde Rifaldehyde

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CAS Number: 13292-22-3

Other Names:

3-Formylrifamycin

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.67 8.61 -25.75 6 14 0 218 725.788 4 ↓
Hi High (pH 8-9.5) 2.67 9.71 -80.6 5 14 -1 221 724.78 4 ↓
Hi High (pH 8-9.5) 2.67 9.85 -60.98 5 14 -1 221 724.78 4 ↓

Vendor Notes

Note Type Comments Provided By
biological_use Antibiotic IBScreen Bioactives
mechanism Inhibitor of bacterial DNA-dependent RNA polymerase and viral IBScreen Bioactives
mechanism RNA-dependent DNA polymerase IBScreen Bioactives

Activity (Go SEA)

Rings

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

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