General Information of the Compound
| Compound ID |
CP0383385
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| Compound Name |
(4,6-dimethylpyrimidin-2-ylamino)(2-(6-methoxy-1H-indol-3-yl)ethylamino)methaniminium
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| Structure |
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| Formula |
C18H22N6O
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| Molecular Weight |
338.415
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| Canonical SMILES |
COc1ccc2c(CCN=C(N)Nc3nc(C)cc(C)n3)c[nH]c2c1
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| InChI |
InChI=1S/C18H22N6O/c1-11-8-12(2)23-18(22-11)24-17(19)20-7-6-13-10-21-16-9-14(25-3)4-5-15(13)16/h4-5,8-10,21H,6-7H2,1-3H3,(H3,19,20,22,23,24)
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| InChIKey |
MBTYAIBNXXIOCM-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