General Information of the Compound
| Compound ID |
CP0531454
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| Compound Name |
UNC10108005
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| Structure |
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| Formula |
C21H24Cl2N4O2
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| Molecular Weight |
435.355
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| Canonical SMILES |
Clc1cccc(N2CCCN(CCCOc3ccc4[nH]c(=O)[nH]c4c3)CC2)c1Cl
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| InChI |
InChI=1S/C21H24Cl2N4O2/c22-16-4-1-5-19(20(16)23)27-10-2-8-26(11-12-27)9-3-13-29-15-6-7-17-18(14-15)25-21(28)24-17/h1,4-7,14H,2-3,8-13H2,(H2,24,25,28)
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| InChIKey |
ARPHSPFYEOAIMK-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