General Information of the Compound
| Compound ID |
CP0418283
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| Compound Name |
1-(5-(4-phenylpiperazin-1-yl)pentyl)benzo[cd]indol-2(1H)-one
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| Synonyms |
1-(5-(4-phenylpiperazin-1-yl)pentyl)benzo[cd]indol-2(1H)-one
1-[5-(4-Phenylpiperazino)pentyl]-1,2-dihydrobenzo[cd]indole-2-one
BDBM50240359
CHEMBL12259
UCM-5600
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| Structure |
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| Formula |
C26H29N3O
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| Molecular Weight |
399.538
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| Canonical SMILES |
O=C1N(CCCCCN2CCN(CC2)c2ccccc2)c2cccc3cccc1c23
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| InChI |
InChI=1S/C26H29N3O/c30-26-23-13-7-9-21-10-8-14-24(25(21)23)29(26)16-6-2-5-15-27-17-19-28(20-18-27)22-11-3-1-4-12-22/h1,3-4,7-14H,2,5-6,15-20H2
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| InChIKey |
UPZHUDFDXXFEKG-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
Clinical Information about the Compound