General Information of the Compound
| Compound ID |
CP0481835
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| Compound Name |
2-(5-bromo-1H-indol-3-yl)ethanamine
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| Structure |
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| Formula |
C10H11BrN2
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| Molecular Weight |
239.116
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| Canonical SMILES |
NCCc1c[nH]c2ccc(Br)cc12
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| InChI |
InChI=1S/C10H11BrN2/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10/h1-2,5-6,13H,3-4,12H2
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| InChIKey |
CGHUQJRRADEHTQ-UHFFFAOYSA-N
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| CAS |
3610-42-2
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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