General Information of the Compound
| Compound ID |
CP0519183
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| Compound Name |
(1H-Benzoimidazol-2-yl)-(1,2,3,4-tetrahydrophenanthren-4-yl)amine
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| Structure |
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| Formula |
C21H19N3
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| Molecular Weight |
313.404
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| Canonical SMILES |
C1CC(Nc2nc3ccccc3[nH]2)c2c(C1)ccc1ccccc21
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| InChI |
InChI=1S/C21H19N3/c1-2-8-16-14(6-1)12-13-15-7-5-11-19(20(15)16)24-21-22-17-9-3-4-10-18(17)23-21/h1-4,6,8-10,12-13,19H,5,7,11H2,(H2,22,23,24)
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| InChIKey |
ZBIBQVJNOROCLB-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