CEFACLOR

Search structure
Trade Names:
Synonyms:
Status: Approved (1979)
Entry Type: Small molecule
Molecule Category: Parent
ATC: J01DC04
UNII: 3Z6FS3IK0K

Structure
InChI Key QYIYFLOTGYLRGG-GPCCPHFNSA-N
Smile N[C@@H](C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(Cl)CS[C@H]12)c1ccccc1
InChI
InChI=1S/C15H14ClN3O4S/c16-8-6-24-14-10(13(21)19(14)11(8)15(22)23)18-12(20)9(17)7-4-2-1-3-5-7/h1-5,9-10,14H,6,17H2,(H,18,20)(H,22,23)/t9-,10-,14-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H14ClN3O4S
Molecular Weight 367.81
AlogP 0.62
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 112.73
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 24.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial penicillin-binding protein inhibitor PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC15 family of peptide transporters
- - - 28840-29000 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 114

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Osteomyelitis 0 D010019 ClinicalTrials

Related Entries

MCS

Scaffolds

Side Effects from Label

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Immune system disorders
29.25
Skin and subcutaneous tissue disorders
14.53
General disorders and administration site conditions
9.69
Gastrointestinal disorders
7.98
Vascular disorders
6.08
Nervous system disorders
5.22
Respiratory, thoracic and mediastinal disorders
4.37
Infections and infestations
3.8
Injury, poisoning and procedural complications
3.23
Investigations
3.23
Musculoskeletal and connective tissue disorders
2.28

Cross References

Resources Reference
ChEBI 3478
ChEMBL CHEMBL680
DrugBank DB00833
DrugCentral 525
EPA CompTox DTXSID3022748
FDA SRS 3Z6FS3IK0K
Human Metabolome Database HMDB0014971
KEGG C06877
SureChEMBL SCHEMBL33540
ZINC ZINC000003812869
ChEMBL CHEMBL1201018
FDA SRS 69K7K19H4L
SureChEMBL SCHEMBL33539
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