UCSF

ZINC19702757

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2008 17 Yes

Popular Name: Ethyl 4-amino-6-fluoro-3-quinolinecarboxylate Ethyl 4-amino-6-fluoro-3-quinoli…

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CAS Number: 1018127-51-9

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) 1.01 4.56 -6.37 2 4 0 65 234.23 3 ↓
Mid Mid (pH 6-8) 1.01 4.96 -33.97 3 4 1 66 235.238 3 ↓

Activity (Go SEA)

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