UCSF

ZINC04324631

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2005 26 Yes

Popular Name: N-(4-chlorophenyl)-N'-[2-methyl-5-(piperidinosulfonyl)-3-furyl]urea N-(4-chlorophenyl)-N'-[2-methyl-…

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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) 3.50 5.12 -16.91 2 7 0 92 397.884 4 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
LIPE-1-E Endothelial Lipase (cluster #1 Of 1), Eukaryotic Eukaryotes 200 0.36 Binding ≤ 10μM
LIPL-1-E Lipoprotein Lipase (cluster #1 Of 1), Eukaryotic Eukaryotes 130 0.37 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
LIPE_HUMAN Q9Y5X9 Endothelial Lipase, Human 200 0.36 Binding ≤ 1μM
LIPL_RAT Q06000 Lipoprotein Lipase, Rat 130 0.37 Binding ≤ 1μM
LIPE_HUMAN Q9Y5X9 Endothelial Lipase, Human 200 0.36 Binding ≤ 10μM
LIPL_RAT Q06000 Lipoprotein Lipase, Rat 130 0.37 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Chylomicron-mediated lipid transport
Retinoid metabolism and transport
Transcriptional regulation of white adipocyte differentiation

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

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