Drug General Information
Drug ID
D0AT2Z
Former ID
DNC003596
Drug Name
3-Phenylsulfanylmethyl-quinoxaline-5,7-diamine
Drug Type
Small molecular drug
Indication Discovery agent Investigative [533598]
Structure
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2D MOL

3D MOL

Formula
C15H14N4S
Canonical SMILES
C1=CC=C(C=C1)SCC2=NC3=C(C=C(C=C3N=C2)N)N
InChI
1S/C15H14N4S/c16-10-6-13(17)15-14(7-10)18-8-11(19-15)9-20-12-4-2-1-3-5-12/h1-8H,9,16-17H2
InChIKey
PBRHNJQCRCVADQ-UHFFFAOYSA-N
PubChem Compound ID
Target and Pathway
Target(s) Dihydrofolate reductase Target Info Inhibitor [533598]
PathWhiz Pathway Folate Metabolism
Pterine Biosynthesis
Reactome E2F mediated regulation of DNA replication
Tetrahydrobiopterin (BH4) synthesis, recycling, salvage and regulation
Metabolism of folate and pterines
G1/S-Specific Transcription
References
Ref 533598J Med Chem. 1995 Nov 24;38(24):4739-59.New drug developments for opportunistic infections in immunosuppressed patients: Pneumocystis carinii.
Ref 533598J Med Chem. 1995 Nov 24;38(24):4739-59.New drug developments for opportunistic infections in immunosuppressed patients: Pneumocystis carinii.

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