General Information of the Compound
| Compound ID |
CP0948228
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| Compound Name |
(5-(Isoquinolin-4-yl)-1H-indol-2-yl)methanamine
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| Structure |
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| Formula |
C18H15N3
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| Molecular Weight |
273.339
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| Canonical SMILES |
NCc1cc2cc(-c3cncc4ccccc34)ccc2[nH]1
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| InChI |
InChI=1S/C18H15N3/c19-9-15-8-14-7-12(5-6-18(14)21-15)17-11-20-10-13-3-1-2-4-16(13)17/h1-8,10-11,21H,9,19H2
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| InChIKey |
FLPMQCCKRZPVQD-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