Structure

InChI Key HSBKFSPNDWWPSL-CAHLUQPWSA-N
Smile Nc1nc(=O)n([C@H]2C=C[C@@H](CO)O2)cc1F
InChI
InChI=1S/C9H10FN3O3/c10-6-3-13(9(15)12-8(6)11)7-2-1-5(4-14)16-7/h1-3,5,7,14H,4H2,(H2,11,12,15)/t5-,7+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H10FN3O3
Molecular Weight 227.19
AlogP -0.59
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 90.37
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Human immunodeficiency virus type 1 reverse transcriptase inhibitor ClinicalTrials

Indications

Mesh Heading Maximum Phase Mesh ID Reference
HIV Infections 2 D015658 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 134379-77-4
ChEMBL CHEMBL109831
DrugBank DB12470
EPA CompTox DTXSID20158678
FDA SRS KU8SPJ271W
PubChem 64973
SureChEMBL SCHEMBL599014
ZINC ZINC000000002300