General Information of the Compound
| Compound ID |
CP0945526
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| Compound Name |
11,12-Dihydro-6H-dibenzo[b,f]azocine-5-carboxamidine hydrochloride
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| Structure |
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| Formula |
C16H18ClN3
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| Molecular Weight |
287.794
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| Canonical SMILES |
Cl.N=C(N)N1Cc2ccccc2CCc2ccccc21
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| InChI |
InChI=1S/C16H17N3.ClH/c17-16(18)19-11-14-7-2-1-5-12(14)9-10-13-6-3-4-8-15(13)19;/h1-8H,9-11H2,(H3,17,18);1H
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| InChIKey |
YUVBFIZKBBDPSI-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