General Information of the Compound
| Compound ID |
CP0923512
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| Compound Name |
1-Phenyl-2-[3-(pyrrolidin-1-yl)propyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
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| Structure |
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| Formula |
C24H29N3
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| Molecular Weight |
359.517
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| Canonical SMILES |
c1ccc(C2c3[nH]c4ccccc4c3CCN2CCCN2CCCC2)cc1
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| InChI |
InChI=1S/C24H29N3/c1-2-9-19(10-3-1)24-23-21(20-11-4-5-12-22(20)25-23)13-18-27(24)17-8-16-26-14-6-7-15-26/h1-5,9-12,24-25H,6-8,13-18H2
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| InChIKey |
PXIPTYSJXWRLOR-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