UCSF

ZINC00065268

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 19 Yes

Popular Name: 2-Pyridin-4-ylquinoline-4-carboxylic acid 2-Pyridin-4-ylquinoline-4-carbox…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 14228-23-0 , [14228-23-0]

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 2.35 7.22 -47.94 0 4 -1 66 249.249 2 ↓
Lo Low (pH 4.5-6) 2.35 7.68 -65.25 1 4 0 67 250.257 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 308 - 310 Enamine Building Blocks
MP 308...310 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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