BIAPENEM

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: J01DH05
UNII: YR5U3L9ZH1

Structure
InChI Key MRMBZHPJVKCOMA-YJFSRANCSA-N
Smile C[C@@H](O)[C@H]1C(=O)N2C(C(=O)[O-])=C(SC3Cn4cnc[n+]4C3)[C@H](C)[C@H]12
InChI
InChI=1S/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8-,10-,11-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H18N4O4S
Molecular Weight 350.4
AlogP -1.89
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 102.37
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 24.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 120410-24-4
ChEBI 3089
ChEMBL CHEMBL285347
DrugBank DB13028
DrugCentral 365
EPA CompTox DTXSID5046435
FDA SRS YR5U3L9ZH1
KEGG C11268
PubChem 71339
SureChEMBL SCHEMBL49242
CONTENTS