General Information of the Compound
| Compound ID |
CP0580073
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| Compound Name |
3-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-1H-benzimidazol-2-one
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| Structure |
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| Formula |
C26H28N4O
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| Molecular Weight |
412.537
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| Canonical SMILES |
O=c1[nH]c2ccccc2n1CCN1CCN(CC1)C(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C26H28N4O/c31-26-27-23-13-7-8-14-24(23)30(26)20-17-28-15-18-29(19-16-28)25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,25H,15-20H2,(H,27,31)
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| InChIKey |
IPBSBUQDPNMEBC-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