General Information of the Compound
| Compound ID |
CP0549700
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| Compound Name |
5-chloro-4-[4-[(3-methylpyridin-2-yl)methyl]piperazin-1-yl]-1H-pyridazin-6-one
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| Structure |
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| Formula |
C15H18ClN5O
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| Molecular Weight |
319.796
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| Canonical SMILES |
Cc1cccnc1CN1CCN(CC1)c1cn[nH]c(=O)c1Cl
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| InChI |
InChI=1S/C15H18ClN5O/c1-11-3-2-4-17-12(11)10-20-5-7-21(8-6-20)13-9-18-19-15(22)14(13)16/h2-4,9H,5-8,10H2,1H3,(H,19,22)
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| InChIKey |
PFCRPZLPCGDRNZ-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