UCSF

ZINC27523897

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 20 No

Popular Name: 4-(hydroxyamino)-1-[(2R,4S,5R)-4-hydroxy-5-(2-hydroxyethyl)tetrahydrofuran-2-yl]-5-(hydroxymethyl)py 4-(hydroxyamino)-1-[(2R,4S,5R)-4…

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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) -2.06 -7.82 -27.06 5 9 0 137 287.272 5 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z80208-1-O L5178Y (Lymphoma Cells) (cluster #1 Of 2), Other Other 9100 0.35 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z80208 Z80208 L5178Y (Lymphoma Cells) 4000 0.38 Functional ≤ 10μM

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