General Information of the Compound
| Compound ID |
CP0382469
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| Compound Name |
3-(1H-Inden-2-yl)pyridine
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| Synonyms |
3-(1H-inden-2-yl)pyridine
AC1O70H3
BDBM8888
CHEMBL205782
SCHEMBL4504698
indene 1
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| Structure |
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| Formula |
C14H11N
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| Molecular Weight |
193.249
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| Canonical SMILES |
C1C(=Cc2ccccc12)c1cccnc1
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| InChI |
InChI=1S/C14H11N/c1-2-5-12-9-14(8-11(12)4-1)13-6-3-7-15-10-13/h1-8,10H,9H2
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| InChIKey |
NNEAKBWZBQOQDH-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: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial
Clinical Information about the Compound