PF-06273340

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Synonyms
Status
Molecule Category Free-form
UNII I136775ABW

Structure

InChI Key BPIWZDNVMQQBQX-UHFFFAOYSA-N
Smiles CC(C)(CO)n1cc(C(=O)c2cncc(NC(=O)Cc3ccc(Cl)cn3)c2)c2cnc(N)nc21
InChI
InChI=1S/C23H22ClN7O3/c1-23(2,12-32)31-11-18(17-10-28-22(25)30-21(17)31)20(34)13-5-16(9-26-7-13)29-19(33)6-15-4-3-14(24)8-27-15/h3-5,7-11,32H,6,12H2,1-2H3,(H,29,33)(H2,25,28,30)

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H22ClN7O3
Molecular Weight 479.93
AlogP 2.6
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 7.0
Polar Surface Area 148.91
Molecular species NEUTRAL
Aromatic Rings 4.0
Heavy Atoms 34.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase DDR family
- - - - 60
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Musk family
- 53 - - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase PDGFR family
- 53 - - -
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Trk family
- 3-6 - - -
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4D
- - - - 54
Enzyme Phosphodiesterase Phosphodiesterase 5 Phosphodiesterase 5A
- - - - 54
Enzyme Phosphodiesterase Phosphodiesterase 7 Phosphodiesterase 7B
- - - - 54
Enzyme Phosphodiesterase Phosphodiesterase 8 Phosphodiesterase 8B
- - - - 54
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 3-53 - - 54-90

Cross References

Resources Reference
ChEMBL CHEMBL4212531
DrugBank DB12269
FDA SRS I136775ABW
PDB 6K4
PubChem 66571548
SureChEMBL SCHEMBL12984736
ZINC ZINC000203540977
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