General Information of the Compound
| Compound ID |
CP0472922
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| Compound Name |
4-[2-(1,2,3,4-tetrahydropyrido[3,4-b]indol-9-ylmethyl)benzimidazol-1-yl]butan-1-ol
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| Structure |
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| Formula |
C23H26N4O
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| Molecular Weight |
374.488
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| Canonical SMILES |
OCCCCn1c(Cn2c3CNCCc3c3ccccc23)nc2ccccc12
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| InChI |
InChI=1S/C23H26N4O/c28-14-6-5-13-26-21-10-4-2-8-19(21)25-23(26)16-27-20-9-3-1-7-17(20)18-11-12-24-15-22(18)27/h1-4,7-10,24,28H,5-6,11-16H2
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| InChIKey |
DJVHDNQFYKNAOE-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