CEFORANIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (1984)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: J01DC11
UNII: 8M1YF8951V

Structure
InChI Key SLAYUXIURFNXPG-CRAIPNDOSA-N
Smile NCc1ccccc1CC(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@H]12
InChI
InChI=1S/C20H21N7O6S2/c21-6-11-4-2-1-3-10(11)5-13(28)22-15-17(31)27-16(19(32)33)12(8-34-18(15)27)9-35-20-23-24-25-26(20)7-14(29)30/h1-4,15,18H,5-9,21H2,(H,22,28)(H,29,30)(H,32,33)/t15-,18-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H21N7O6S2
Molecular Weight 519.57
AlogP -0.71
Hydrogen Bond Acceptor 11.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 10.0
Polar Surface Area 193.63
Molecular species ZWITTERION
Aromatic Rings 2.0
Heavy Atoms 35.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial penicillin-binding protein inhibitor PubMed PubMed Wikipedia

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 60925-61-3
ChEBI 3495
ChEMBL CHEMBL1201046
DrugBank DB00923
DrugCentral 544
EPA CompTox DTXSID1022760
FDA SRS 8M1YF8951V
Human Metabolome Database HMDB0015059
KEGG C06884
PharmGKB PA164746057
PubChem 43507
SureChEMBL SCHEMBL122072
ZINC ZINC000003830434
CONTENTS