Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: U9T63BZ3AS

Structure

InChI Key SRICOHRDRMZREQ-MRXNPFEDSA-N
Smile O=c1ccc2ccc(F)c3c2n1C[C@H]3CN1CCC(NCc2cc3c(nn2)OCCO3)CC1
InChI
InChI=1S/C24H26FN5O3/c25-19-3-1-15-2-4-21(31)30-14-16(22(19)23(15)30)13-29-7-5-17(6-8-29)26-12-18-11-20-24(28-27-18)33-10-9-32-20/h1-4,11,16-17,26H,5-10,12-14H2/t16-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H26FN5O3
Molecular Weight 451.5
AlogP 2.05
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 81.51
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 33.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Infections 1 D007239 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL3793226
DrugBank DB15345
FDA SRS U9T63BZ3AS
PDB 6EJ
PubChem 119057475
ZINC ZINC000138115734