General Information of the Compound
| Compound ID |
CP0408306
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| Compound Name |
3-chloro-1,13-diazatricyclo[8.6.0.02,7]hexadeca-2(7),3,5-triene
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| Structure |
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| Formula |
C14H19ClN2
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| Molecular Weight |
250.773
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| Canonical SMILES |
Clc1cccc2CCC3CCNCCCN3c12
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| InChI |
InChI=1S/C14H19ClN2/c15-13-4-1-3-11-5-6-12-7-9-16-8-2-10-17(12)14(11)13/h1,3-4,12,16H,2,5-10H2
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| InChIKey |
UAPJPSLLIFFBKM-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: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C