UCSF

ZINC04226229

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 19 Yes

Popular Name: 4-(2-Hydroxy-ethylamino)-6-methoxy-quinoline-3-carboxylic acid 4-(2-Hydroxy-ethylamino)-6-metho…

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CAS Numbers: 878691-40-8 , N/A

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) 0.98 -3.92 -48.17 3 6 0 95 262.265 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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