General Information of the Compound
| Compound ID |
CP0464505
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| Compound Name |
12-methyl-5,6,7,12-tetrahydro-benzo[6,7]cyclohepta[1,2-b]indol-10-ol
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| Structure |
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| Formula |
C18H17NO
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| Molecular Weight |
263.34
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| Canonical SMILES |
Cn1c-2c(CCCc3ccccc-23)c2ccc(O)cc12
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| InChI |
InChI=1S/C18H17NO/c1-19-17-11-13(20)9-10-15(17)16-8-4-6-12-5-2-3-7-14(12)18(16)19/h2-3,5,7,9-11,20H,4,6,8H2,1H3
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| InChIKey |
LGQASALZGMUVJX-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