General Information of the Compound
| Compound ID |
CP0424613
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| Compound Name |
2-chloro-7-(5-piperidin-1-ylpentoxy)xanthen-9-one
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| Structure |
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| Formula |
C23H26ClNO3
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| Molecular Weight |
399.918
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| Canonical SMILES |
Clc1ccc2oc3ccc(OCCCCCN4CCCCC4)cc3c(=O)c2c1
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| InChI |
InChI=1S/C23H26ClNO3/c24-17-7-9-21-19(15-17)23(26)20-16-18(8-10-22(20)28-21)27-14-6-2-5-13-25-11-3-1-4-12-25/h7-10,15-16H,1-6,11-14H2
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| InChIKey |
AQIRLJIMBMOXCB-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