General Information of the Compound
| Compound ID |
CP0382448
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| Compound Name |
2-Methyl-4,5,6,7,9,10-hexahydro-8H-5,7a-diaza-benzo[cd]cyclopenta[a]azulene
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| Structure |
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| Formula |
C15H18N2
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| Molecular Weight |
226.323
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| Canonical SMILES |
Cc1cc2CNCCn3c4CCCc4c(c1)c23
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| InChI |
InChI=1S/C15H18N2/c1-10-7-11-9-16-5-6-17-14-4-2-3-12(14)13(8-10)15(11)17/h7-8,16H,2-6,9H2,1H3
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| InChIKey |
CEQIGJXBXWLXPJ-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C