General Information of the Compound
| Compound ID |
CP0517008
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| Compound Name |
CHEMBL2338244
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| Formula |
C24H30N4O2
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| Molecular Weight |
406.53
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| Canonical SMILES |
CC1(C)CCN([C@H]2C3CC4CC2C[C@@](O)(C4)C3)C(=O)c2cnn(c12)-c1ccccn1
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| InChI |
InChI=1S/C24H30N4O2/c1-23(2)6-8-27(20-16-9-15-10-17(20)13-24(30,11-15)12-16)22(29)18-14-26-28(21(18)23)19-5-3-4-7-25-19/h3-5,7,14-17,20,30H,6,8-13H2,1-2H3/t15?,16?,17?,20-,24+
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| InChIKey |
JIFHNJNJKQBZGU-MALZWFGSSA-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