ALATROFLOXACIN

Search structure
Synonyms:
Status: Approved (1997)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 7QVV6I50DT

Structure
InChI Key UUZPPAMZDFLUHD-VUJLHGSVSA-N
Smile C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@H]1[C@@H]2CN(c3nc4c(cc3F)c(=O)c(C(=O)O)cn4-c3ccc(F)cc3F)C[C@@H]21
InChI
InChI=1S/C26H25F3N6O5/c1-10(30)24(37)31-11(2)25(38)32-20-14-7-34(8-15(14)20)23-18(29)6-13-21(36)16(26(39)40)9-35(22(13)33-23)19-4-3-12(27)5-17(19)28/h3-6,9-11,14-15,20H,7-8,30H2,1-2H3,(H,31,37)(H,32,38)(H,39,40)/t10-,11-,14-,15+,20+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H25F3N6O5
Molecular Weight 558.52
AlogP 0.9
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 7.0
Polar Surface Area 159.65
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 40.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135829
ChEMBL CHEMBL1201197
DrugBank DB09335
DrugCentral 102
EPA CompTox DTXSID4057893
FDA SRS 7QVV6I50DT
SureChEMBL SCHEMBL7616277
ZINC ZINC000100067477
CONTENTS