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Compound InformationSONAR Target prediction
Name:

Chlorpropamide

Unique Identifier:LOPAC 00030
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10ClH13N2O3S
Molecular Weight:263.637 g/mol
X log p:7.851  (online calculus)
Lipinksi Failures1
TPSA59.59
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:6
Canonical Smiles:CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1
Class:Hormone
Action:Releaser
Selectivity:Insulin
Generic_name:Chlorpropamide
Chemical_iupac_name:N-(4-chlorophenyl)sulfonylmethanamide
Drug_type:Approved Drug
Pharmgkb_id:PA448966
Kegg_compound_id:C06907
Drugbank_id:APRD00029
Melting_point:127 - 129 oC
H2o_solubility:Solubility at pH 6 is 2.2 mg/ml
Logp:2.653
Cas_registry_number:94-20-2
Mass_spectrum:http://webbook.nist.gov/cgi/cbook.cgi?Spec=C94202&Index=0&Type=Mass&Large=on
Drug_category:Hypoglycemic Agents; Sulfonylureas; ATC:A10BB02
Indication:For managing hyperglycemia in Non-insulin-dependent diabetes mellitus (NIDDM).
Pharmacology:Chlorpropamide, a second-generation sulfonylurea antidiabetic agent, is used with
diet to lower blood glucose levels in patients with diabetes mellitus type II.
Chlorpropamide is twice as potent as the related second-generation agent glipizide.
Mechanism_of_action:Sulfonylureas such as Chlorpropamide likely bind to ATP-sensitive potassium-channel
receptors on the pancreatic cell surface, reducing potassium conductance and causing
depolarization of the membrane. Depolarization stimulates calcium ion influx through
voltage-sensitive calcium channels, raising intracellular concentrations of calcium
ions, which induces the secretion, or exocytosis, of insulin.
Organisms_affected:Humans and other mammals

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24
Species: 4932
Condition: WHI5
Replicates: 2
Raw OD Value: r im 0.6080±0.011738
Normalized OD Score: sc h 0.9851±0.00431952
Z-Score: -0.4575±0.184668
p-Value: 0.650138
Z-Factor: -6.34273
Fitness Defect: 0.4306
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:3|G10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.045825000000000005±0.00080
Plate DMSO Control (-):0.701225±0.13565
Plate Z-Factor:0.2500
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DBLink | Rows returned: 3
2727 1-(4-chlorophenyl)sulfonyl-3-propyl-urea
253746 1-(4-chlorophenyl)sulfonyl-3-cyclopropyl-urea
3040371 1-(4-chlorophenyl)sulfonyl-3-(2-methylpropyl)urea

internal high similarity DBLink | Rows returned: 1
SPE01500185 1.0000

active | Cluster 17828 | Additional Members: 9 | Rows returned: 0

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