General Information of the Compound
| Compound ID |
CP0346650
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| Compound Name |
US10336717, Compound 55
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| Formula |
C24H29N3O2
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| Molecular Weight |
391.515
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| Canonical SMILES |
CO[C@H]1CC[C@@]2(Cc3ccc(cc3C22CC(=O)N(C)C(N)=N2)C#CC2CC2)CC1
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| InChI |
InChI=1S/C24H29N3O2/c1-27-21(28)15-24(26-22(27)25)20-13-17(6-5-16-3-4-16)7-8-18(20)14-23(24)11-9-19(29-2)10-12-23/h7-8,13,16,19H,3-4,9-12,14-15H2,1-2H3,(H2,25,26)/t19-,23-,24?
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| InChIKey |
ZZMSMTYJMCOVRM-AHLJTMJASA-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