General Information of the Compound
| Compound ID |
CP0484432
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| Compound Name |
US9346829, 20
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| Formula |
C23H26N4O2
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| Molecular Weight |
390.487
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| Canonical SMILES |
CN1[C@H]2COC[C@@H]1C[C@@H](C2)NC(=O)c1cn(-c2cccnc2C)c2ccccc12
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| InChI |
InChI=1S/C23H26N4O2/c1-15-21(8-5-9-24-15)27-12-20(19-6-3-4-7-22(19)27)23(28)25-16-10-17-13-29-14-18(11-16)26(17)2/h3-9,12,16-18H,10-11,13-14H2,1-2H3,(H,25,28)/t16-,17-,18+
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| InChIKey |
YYNMAWNXIUMHBA-NNZMDNLPSA-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