General Information of the Compound
| Compound ID |
CP0494948
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| Compound Name |
US9422293, 32
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| Structure |
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| Formula |
C27H30N6
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| Molecular Weight |
438.579
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| Canonical SMILES |
Cc1nc2ccccc2nc1N1CCc2ncnc(Nc3ccc(cc3)C(C)(C)C)c2CC1
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| InChI |
InChI=1S/C27H30N6/c1-18-26(32-24-8-6-5-7-23(24)30-18)33-15-13-21-22(14-16-33)28-17-29-25(21)31-20-11-9-19(10-12-20)27(2,3)4/h5-12,17H,13-16H2,1-4H3,(H,28,29,31)
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| InChIKey |
IDJQPTDUJNRQAX-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: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1