General Information of the Compound
| Compound ID |
CP0542267
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| Compound Name |
US9422293, 33
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| Structure |
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| Formula |
C30H36N6
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| Molecular Weight |
480.66
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| Canonical SMILES |
CC(C)c1nc2CCN(CCc2c(Nc2ccc(cc2)C(C)(C)C)n1)c1nc2ccccc2nc1C
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| InChI |
InChI=1S/C30H36N6/c1-19(2)27-33-24-16-18-36(29-20(3)31-25-9-7-8-10-26(25)34-29)17-15-23(24)28(35-27)32-22-13-11-21(12-14-22)30(4,5)6/h7-14,19H,15-18H2,1-6H3,(H,32,33,35)
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| InChIKey |
VSZWWYRSSXYUJO-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