General Information of the Compound
| Compound ID |
CP0117621
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| Compound Name |
6-chloro-N-[(2R)-2-(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 |
C[C@H](CNc1cncc(Cl)n1)N1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C17H22ClN5/c1-14(11-20-17-13-19-12-16(18)21-17)22-7-9-23(10-8-22)15-5-3-2-4-6-15/h2-6,12-14H,7-11H2,1H3,(H,20,21)/t14-/m1/s1
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| InChIKey |
BFYYVQSKMOOSPC-CQSZACIVSA-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