General Information of the Compound
| Compound ID |
CP0488966
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| Compound Name |
1-(3-hydroxypropyl)-5-[2-[2-(2-methylphenoxy)ethylamino]propyl]-2,3-dihydroindole-7-carboxamide
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| Structure |
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| Formula |
C24H33N3O3
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| Molecular Weight |
411.546
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| Canonical SMILES |
CC(Cc1cc2CCN(CCCO)c2c(c1)C(N)=O)NCCOc1ccccc1C
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| InChI |
InChI=1S/C24H33N3O3/c1-17-6-3-4-7-22(17)30-13-9-26-18(2)14-19-15-20-8-11-27(10-5-12-28)23(20)21(16-19)24(25)29/h3-4,6-7,15-16,18,26,28H,5,8-14H2,1-2H3,(H2,25,29)
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| InChIKey |
RHOLYPCFUBNRPR-UHFFFAOYSA-N
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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: PT01089, Alpha-1A adrenergic receptor
Protein ID: PT01007, Alpha-1B adrenergic receptor
Protein ID: PT01004, Alpha-1D adrenergic receptor