General Information of the Compound
| Compound ID |
CP0377585
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| Compound Name |
(1-Dimethylaminomethyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl)-dipropyl-amine
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| Structure |
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| Formula |
C21H33N3
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| Molecular Weight |
327.516
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| Canonical SMILES |
CCCN(CCC)C1CCc2ccc3[nH]cc(CN(C)C)c3c2C1
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| InChI |
InChI=1S/C21H33N3/c1-5-11-24(12-6-2)18-9-7-16-8-10-20-21(19(16)13-18)17(14-22-20)15-23(3)4/h8,10,14,18,22H,5-7,9,11-13,15H2,1-4H3
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| InChIKey |
BZORTZGFMNCZKW-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