UCSF

ZINC95921766

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2014 0 Yes

Popular Name: ethyl 2-amino-4-(3,4-difluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate ethyl 2-amino-4-(3,4-difluorophe…

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CAS Number: 664999-75-1

Other Names:

MFCD03863357

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) 1.13 4.16 -14.99 3 7 0 112 379.315 5 ↓

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

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