General Information of the Compound
| Compound ID |
CP0429387
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| Compound Name |
(2S,4R)-N-[(2-methoxyphenyl)methyl]-3,3,9-trimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxamide
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| Structure |
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| Formula |
C19H23N3O2
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| Molecular Weight |
325.412
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| Canonical SMILES |
COc1ccccc1CNC(=O)c1nn(C)c2[C@H]3[C@@H](Cc12)C3(C)C
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| InChI |
InChI=1S/C19H23N3O2/c1-19(2)13-9-12-16(21-22(3)17(12)15(13)19)18(23)20-10-11-7-5-6-8-14(11)24-4/h5-8,13,15H,9-10H2,1-4H3,(H,20,23)/t13-,15-/m1/s1
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| InChIKey |
FRCXVVHOMGIXGZ-UKRRQHHQSA-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: PT03095, Voltage-dependent T-type calcium channel subunit alpha-1G
Protein ID: PT04557, Voltage-dependent T-type calcium channel subunit alpha-1H
Protein ID: PT02881, Voltage-dependent T-type calcium channel subunit alpha-1I