General Information of the Compound
| Compound ID |
CP0009782
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| Compound Name |
1-(6-Chloro-pyridin-3-ylmethyl)-imidazolidin-(2Z)-ylideneamine
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| Structure |
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| Formula |
C9H11ClN4
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| Molecular Weight |
210.668
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| Canonical SMILES |
NC1=NCCN1Cc1ccc(Cl)nc1
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| InChI |
InChI=1S/C9H11ClN4/c10-8-2-1-7(5-13-8)6-14-4-3-12-9(14)11/h1-2,5H,3-4,6H2,(H2,11,12)
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| InChIKey |
UEQZFAGVRGWPDK-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
Protein ID: PT03766, Acetylcholine receptor subunit alpha
Protein ID: PT02515, Neuronal acetylcholine receptor subunit alpha-3
Protein ID: PT07206, Neuronal acetylcholine receptor subunit alpha-4
Protein ID: PT01846, Neuronal acetylcholine receptor subunit alpha-7