General Information of the Compound
| Compound ID |
CP0401350
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| Compound Name |
1-Benzyl-1H-benzoimidazole-2-carboxylic acid [3-(9-methyl-3,9-diaza-spiro[5.5]undec-3-yl)-3-oxo-propyl]-amide
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| Structure |
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| Formula |
C28H35N5O2
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| Molecular Weight |
473.621
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| Canonical SMILES |
CN1CCC2(CC1)CCN(CC2)C(=O)CCNC(=O)c1nc2ccccc2n1Cc1ccccc1
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| InChI |
InChI=1S/C28H35N5O2/c1-31-17-12-28(13-18-31)14-19-32(20-15-28)25(34)11-16-29-27(35)26-30-23-9-5-6-10-24(23)33(26)21-22-7-3-2-4-8-22/h2-10H,11-21H2,1H3,(H,29,35)
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| InChIKey |
HWZDSHWAPUQVMF-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