ASP-5878

Search structure


Synonyms:	ASP 5878 ASP5878
Status:	Phase 1
Entry Type:	Small molecule
Molecule Category:	UNKNOWN
UNII:	C0Z095LL72

Structure


InChI Key	VDZZYOJYLLNBTD-UHFFFAOYSA-N
Smile	COc1cc(OC)c(F)c(COc2cnc(Nc3cnn(CCO)c3)nc2)c1F
InChI	InChI=1S/C18H19F2N5O4/c1-27-14-5-15(28-2)17(20)13(16(14)19)10-29-12-7-21-18(22-8-12)24-11-6-23-25(9-11)3-4-26/h5-9,26H,3-4,10H2,1-2H3,(H,21,22,24)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C18H19F2N5O4
Molecular Weight	407.38
AlogP	2.28
Hydrogen Bond Acceptor	9.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	9.0
Polar Surface Area	103.55
Molecular species	NEUTRAL
Aromatic Rings	3.0
Heavy Atoms	29.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase FGFR family	-	0.47-3.5	-	-	50
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase PDGFR family	-	-	-	-	50
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase VEGFR family	-	-	-	-	50
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel	-	-	-	-	7-9.1

Indications

Mesh Heading	Maximum Phase	Mesh ID	Reference
Neoplasms	1	D009369	ClinicalTrials

Cross References

Resources	Reference
ChEMBL	CHEMBL4594428
FDA SRS	C0Z095LL72
PubChem	71736582
SureChEMBL	SCHEMBL15244449

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