linsitinib   Click here for help

GtoPdb Ligand ID: 7423

Synonyms: ASP-7487 | OSI 906 | OSI-906 | OSI906
Compound class: Synthetic organic
Comment: Note that the chemical structure in the PubChem record is for the non-stereo molecule. The INN record specifies stereochemistry as shown in our chemical structure.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 89.33
Molecular weight 421.19
XLogP 4.93
No. Lipinski's rules broken 0
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Canonical SMILES Nc1nccn2c1c(nc2C1CC(C1)(C)O)c1ccc2c(c1)nc(cc2)c1ccccc1
Isomeric SMILES Nc1nccn2c1c(nc2[C@@H]1C[C@](C1)(C)O)c1ccc2c(c1)nc(cc2)c1ccccc1
InChI InChI=1S/C26H23N5O/c1-26(32)14-19(15-26)25-30-22(23-24(27)28-11-12-31(23)25)18-8-7-17-9-10-20(29-21(17)13-18)16-5-3-2-4-6-16/h2-13,19,32H,14-15H2,1H3,(H2,27,28)/t19-,26+
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
9357 linsitinib
Synonyms Click here for help
ASP-7487 | OSI 906 | OSI-906 | OSI906
Database Links Click here for help
CAS Registry No. 867160-71-2
ChEMBL Ligand CHEMBL1091644
GtoPdb PubChem SID 178103995
PubChem CID 11640390
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UniChem Compound Search for chemical match using the InChIKey PKCDDUHJAFVJJB-VLZXCDOPSA-N
UniChem Connectivity Search for chemical match using the InChIKey PKCDDUHJAFVJJB-VLZXCDOPSA-N
Wikipedia Linsitinib