derazantinib   Click here for help

GtoPdb Ligand ID: 9785

Synonyms: ARQ-087 | ARQ087
Compound class: Synthetic organic
Comment: Derazantinib (ARQ087) is an orally bioavailable, non-selective FGFR inhibitor being investigated for antineoplastic activity. Preclinical activity is reported by Hall et al. (2016) [1].
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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 9
Topological polar surface area 59.07
Molecular weight 468.23
XLogP 4.73
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES COCCNCCc1cccc(c1)Nc1ncc2c(n1)c1ccccc1C(C2)c1ccccc1F
Isomeric SMILES COCCNCCc1cccc(c1)Nc1ncc2c(n1)c1ccccc1[C@@H](C2)c1ccccc1F
InChI InChI=1S/C29H29FN4O/c1-35-16-15-31-14-13-20-7-6-8-22(17-20)33-29-32-19-21-18-26(24-10-4-5-12-27(24)30)23-9-2-3-11-25(23)28(21)34-29/h2-12,17,19,26,31H,13-16,18H2,1H3,(H,32,33,34)/t26-/m1/s1
InChI Key KPJDVVCDVBFRMU-AREMUKBSSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(6R)-6-(2-fluorophenyl)-N-[3-[2-(2-methoxyethylamino)ethyl]phenyl]-5,6-dihydrobenzo[h]quinazolin-2-amine
International Nonproprietary Names Click here for help
INN number INN
10488 derazantinib
Synonyms Click here for help
ARQ-087 | ARQ087
Database Links Click here for help
CAS Registry No. 1234356-69-4 (source: WHO INN record)
GtoPdb PubChem SID 354702258
PubChem CID 46834118
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