Basic Description

Synonyms	10-propargyl-5,8-dideazafolic acid \| CB3717 \| TCMDC-131823 \| PDDF \| CHEBI:3258 \| CB-3717 \| CID 443388 \| (2S)-2-[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoyl]amino]pentanedioic acid \| CB3 \| AC1L9EKK \| BDBM18771 \| AKOS040746670 \| DB

Product Properties

ALogP	0.6

Associated Targets(Human)

DHFR Tclin Dihydrofolate reductase (0 Activities)

Discover Target: DHFR

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

TYMS Tclin Thymidylate synthase (14 Activities)

Discover Target: TYMS

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

DHFR Tclin Dihydrofolate reductase (3072 Activities)

Discover Target: DHFR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TYMS Tclin Thymidylate synthase (1651 Activities)

Discover Target: TYMS

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC2A1 Tchem Glucose transporter (14755 Activities)

Discover Target: SLC2A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

WIL2 (182 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HepG2 (196354 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

L1210 (27553 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

L1210 (R7A) (18 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

L1210 (RD1694) (36 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ht1 Hexose transporter 1 (14071 Activities)

Discover Target: ht1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

thyA Thymidylate synthase (EC 2.1.1.45) (TS) (TSase) (9 Activities)

Discover Target: thyA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	(2S)-2-[[4-[(2-amino-4-oxo-3H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoyl]amino]pentanedioic acid
INCHI	InChI=1S/C24H23N5O6/c1-2-11-29(13-14-3-8-18-17(12-14)22(33)28-24(25)27-18)16-6-4-15(5-7-16)21(32)26-19(23(34)35)9-10-20(30)31/h1,3-8,12,19H,9-11,13H2,(H,26,32)(H,30,31)(H,34,35)(H3,25,27,28,33)/t19-/m0/s1
InChi Key	LTKHPMDRMUCUEB-IBGZPJMESA-N
Canonical SMILES	C#CCN(CC1=CC2=C(C=C1)N=C(NC2=O)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
Isomeric SMILES	C#CCN(CC1=CC2=C(C=C1)N=C(NC2=O)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
PubChem CID	135438608
Molecular Weight	477.5

Certificates

Certificate of Analysis(COA)

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Citations of This Product

1. Guohong Yao, Fenfang Li, Shengyi Dong. (2023) Solvent-free bulk soft material with low-temperature tolerance: Transparency, flexibility, stretchability, and adhesion. CHEMICAL ENGINEERING SCIENCE, 281 (119164). [PMID:]
2. Li Gao, Huiying Zuo, Aikun Han, Yaming Sun, Xue Ma, Lijun He, Wenjie Zhao. (2022) Chromatographic Regulation by the Building Blocks for Triazine Polymer-Based Core–Shell Stationary Phases. ACS Applied Polymer Materials, 4 (11): (8057–8064). [PMID:]

References

1. Guohong Yao, Fenfang Li, Shengyi Dong. (2023) Solvent-free bulk soft material with low-temperature tolerance: Transparency, flexibility, stretchability, and adhesion. CHEMICAL ENGINEERING SCIENCE, 281 (119164). [PMID:]
2. Li Gao, Huiying Zuo, Aikun Han, Yaming Sun, Xue Ma, Lijun He, Wenjie Zhao. (2022) Chromatographic Regulation by the Building Blocks for Triazine Polymer-Based Core–Shell Stationary Phases. ACS Applied Polymer Materials, 4 (11): (8057–8064). [PMID:]

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SKU	Size	Availability	Price	Qty
P669303-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90
P669303-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,999.90

10-Propargyl-5,8-dideazafolic acid , CAS No.76849-19-9