General Information of the Compound
| Compound ID |
CP0254388
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| Compound Name |
5-Methoxy-9-oxo-9,10-dihydro-acridine-4-carboxylic acid {4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-ethyl]-phenyl}-amide
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| Synonyms |
143851-98-3
4CA-0489
7066AA
AC-30266
AC1L55DX
AC1Q3EOG
ACN-041487
AKOS016005297
AOB5938
BCP14056
C34H34ClN3O5
CHEMBL2074730
CS-1113
D03968
Elacridar
Elacridar (hydrochloride)
Elacridar HCl
Elacridar hydrochloride
Elacridar hydrochloride (USAN)
Elacridar hydrochloride [USAN]
FT-0696337
GF 120918
GF-120918A
HY-50880
MolPort-023-332-877
N-[4-[2-(3,4-Dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-9,10-dihydro-5-methoxy-9-oxo-4-acridinecarboxamide hydro
NX2BHH1A5B
SCHEMBL15847793
UNII-NX2BHH1A5B
W-5457
gf 120918a
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| Structure |
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| Formula |
C34H33N3O5
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| Molecular Weight |
563.654
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| Canonical SMILES |
COc1cc2CCN(CCc3ccc(NC(=O)c4cccc5c4[nH]c4c(OC)cccc4c5=O)cc3)Cc2cc1OC
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| InChI |
InChI=1S/C34H33N3O5/c1-40-28-9-5-7-26-32(28)36-31-25(33(26)38)6-4-8-27(31)34(39)35-24-12-10-21(11-13-24)14-16-37-17-15-22-18-29(41-2)30(42-3)19-23(22)20-37/h4-13,18-19H,14-17,20H2,1-3H3,(H,35,39)(H,36,38)
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| InChIKey |
OSFCMRGOZNQUSW-UHFFFAOYSA-N
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| CAS |
143664-11-3
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01546, ATP-dependent translocase ABCB1
Protein ID: PT02718, Broad substrate specificity ATP-binding cassette transporter ABCG2
Cell-based Assay
Clinical Information about the Compound