General Information of the Compound
| Compound ID |
CP0518506
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| Compound Name |
US9422293, 38
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| Structure |
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| Formula |
C23H28N6
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| Molecular Weight |
388.519
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| Canonical SMILES |
Cc1cncnc1N1CCc2ncnc(Nc3ccc(cc3)C(C)(C)C)c2CC1
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| InChI |
InChI=1S/C23H28N6/c1-16-13-24-14-27-22(16)29-11-9-19-20(10-12-29)25-15-26-21(19)28-18-7-5-17(6-8-18)23(2,3)4/h5-8,13-15H,9-12H2,1-4H3,(H,25,26,28)
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| InChIKey |
ZURSPBZZSOUWKK-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
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1