General Information of the Compound
| Compound ID |
CP0392087
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| Compound Name |
1-[3-(spiro[indene-1,4'-piperidine]-1'-ylmethyl)carbazol-9-yl]propan-1-one
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| Structure |
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| Formula |
C29H28N2O
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| Molecular Weight |
420.556
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| Canonical SMILES |
CCC(=O)n1c2ccccc2c2cc(CN3CCC4(CC3)C=Cc3ccccc43)ccc12
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| InChI |
InChI=1S/C29H28N2O/c1-2-28(32)31-26-10-6-4-8-23(26)24-19-21(11-12-27(24)31)20-30-17-15-29(16-18-30)14-13-22-7-3-5-9-25(22)29/h3-14,19H,2,15-18,20H2,1H3
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| InChIKey |
FYDHQFNPFFMBCH-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