MEZLOCILLIN

Search structure
Synonyms:
Status: Approved (1981)
Entry Type: Small molecule
Molecule Category: Parent
ATC: J01CA10
UNII: OH2O403D1G

Structure
InChI Key YPBATNHYBCGSSN-VWPFQQQWSA-N
Smile CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2[C@H]1C(=O)O
InChI
InChI=1S/C21H25N5O8S2/c1-21(2)14(18(29)30)26-16(28)13(17(26)35-21)22-15(27)12(11-7-5-4-6-8-11)23-19(31)24-9-10-25(20(24)32)36(3,33)34/h4-8,12-14,17H,9-10H2,1-3H3,(H,22,27)(H,23,31)(H,29,30)/t12-,13-,14+,17-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H25N5O8S2
Molecular Weight 539.59
AlogP -0.23
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 173.5
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 36.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Osteomyelitis 0 D010019 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 6919
ChEMBL CHEMBL1731
DrugBank DB00948
DrugCentral 1795
EPA CompTox DTXSID1023316
FDA SRS OH2O403D1G
Human Metabolome Database HMDB0015083
KEGG C07221
PharmGKB PA164750540
PubChem 656511
SureChEMBL SCHEMBL34075
ZINC ZINC000003831120
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