General Information of the Compound
| Compound ID |
CP0413301
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| Compound Name |
US9422293, 309
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| Structure |
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| Formula |
C30H33F6N5O
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| Molecular Weight |
593.616
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| Canonical SMILES |
CC(Oc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F)C1CCCCC1
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| InChI |
InChI=1S/C30H33F6N5O/c1-18-17-21(29(31,32)33)10-11-24(18)38-26-22-12-15-41(27-23(30(34,35)36)9-6-14-37-27)16-13-25(22)39-28(40-26)42-19(2)20-7-4-3-5-8-20/h6,9-11,14,17,19-20H,3-5,7-8,12-13,15-16H2,1-2H3,(H,38,39,40)
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| InChIKey |
ZFSYJPBRXKHPFB-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