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Lanraplenib monosuccinate

CAT: 0931-T11824L-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T11824L-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1800046-97-2
Target
Syk
Related Pathways
Tyrosine Kinase/Adaptors, Angiogenesis
Bioactivity
Lanraplenib monosuccinate inhibits SYK activity in platelets via the glycoprotein VI (GPVI) receptor without prolonging bleeding time (BT) in monkeys or humans. Lanraplenib monosuccinate is a highly selective and orally active SYK inhibitor (IC50=9.5 nM) in development for the treatment of inflammatory diseases.
Smiles
O=C(O)CCC(=O)O.N1=CC(=NC(=C1)C=2N=C(NC3=CC=C(C=C3)N4CCN(CC4)C5COC5)C6=NC=CN6C2)N
Molecular Formula
C27H31N9O5
Molecular Weight
561.59
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Lanraplenib (monosuccinate)
CAS Number1800046-97-2
PubChem CID118161067
IUPAC Name6-(6-aminopyrazin-2-yl)-N-[4-[4-(oxetan-3-yl)piperazin-1-yl]phenyl]imidazo[1,2-a]pyrazin-8-amine;butanedioic acid
Molecular FormulaC27H31N9O5
Molecular Weight561.6
Topological Polar Surface Area184
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count13
Rotatable Bond Count8
Heavy Atom Count41
Formal Charge0
Complexity728
SMILES
C1CN(CCN1C2COC2)C3=CC=C(C=C3)NC4=NC(=CN5C4=NC=C5)C6=CN=CC(=N6)N.C(CC(=O)O)C(=O)O
InChI
InChI=1S/C23H25N9O.C4H6O4/c24-21-12-25-11-19(28-21)20-13-32-6-5-26-23(32)22(29-20)27-16-1-3-17(4-2-16)30-7-9-31(10-8-30)18-14-33-15-18;5-3(6)1-2-4(7)8/h1-6,11-13,18H,7-10,14-15H2,(H2,24,28)(H,27,29);1-2H2,(H,5,6)(H,7,8)
InChIKey
DVFRSTNNWJHWGW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lanraplenib (monosuccinate)
CAS: 1800046-97-2
CID: 118161067
Formula: C27H31N9O5
MW: 561.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight561.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count13
Rotatable Bond Count8
Exact Mass561.24481512
Monoisotopic Mass561.24481512
Topological Polar Surface Area184 Ų
Heavy Atom Count41
Formal Charge0
Complexity728
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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