General Information of the Compound
| Compound ID |
CP0217050
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| Compound Name |
6-chloro-N-[3-(4-phenylpiperazin-1-yl)propyl]pyrazin-2-amine
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| Structure |
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| Formula |
C17H22ClN5
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| Molecular Weight |
331.851
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| Canonical SMILES |
Clc1cncc(NCCCN2CCN(CC2)c2ccccc2)n1
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| InChI |
InChI=1S/C17H22ClN5/c18-16-13-19-14-17(21-16)20-7-4-8-22-9-11-23(12-10-22)15-5-2-1-3-6-15/h1-3,5-6,13-14H,4,7-12H2,(H,20,21)
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| InChIKey |
RUCWOVBWUVMXEY-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