General Information of the Compound
| Compound ID |
CP0489573
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| Compound Name |
N-cyclopropyl-N-(1H-imidazol-5-ylmethyl)aniline
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| Structure |
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| Formula |
C13H15N3
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| Molecular Weight |
213.284
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| Canonical SMILES |
C(N(C1CC1)c1ccccc1)c1cnc[nH]1
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| InChI |
InChI=1S/C13H15N3/c1-2-4-12(5-3-1)16(13-6-7-13)9-11-8-14-10-15-11/h1-5,8,10,13H,6-7,9H2,(H,14,15)
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| InChIKey |
PAPDNFKIZNYXSW-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