General Information of the Compound
| Compound ID |
CP0405900
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| Compound Name |
5-(alpha)methyl-8-chloro-3,4,5,6-Tetrahydrobenzo[c]quinolizin-3-(4aH)-one
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| Structure |
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| Formula |
C14H14ClNO
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| Molecular Weight |
247.725
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| Canonical SMILES |
C[C@H]1Cc2cc(Cl)ccc2N2C=CC(=O)CC12
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| InChI |
InChI=1S/C14H14ClNO/c1-9-6-10-7-11(15)2-3-13(10)16-5-4-12(17)8-14(9)16/h2-5,7,9,14H,6,8H2,1H3/t9-,14?/m0/s1
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| InChIKey |
OBDCSTNDGGOQNF-CUVJYRNJSA-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