Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: ENPIROLINE
Compound Identifier: 702074
Mol Structure 2D: 702074
Molecular Weight: 404
Formula: C19 H18 F6 N2 O
Development Status: Preclinical
SMILES: OC(C1CCCCN1)c2cc(nc(c2)C(F)(F)F)c3ccc(cc3)C(F)(F)F
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222462D 0 0.00000 0.00000 0^^ 30 32 0 1 0 999 V2000^ 1.4000 -1.0417 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.1917 -1.0792 0.0000 C 0 0 3 0 0 0 0 0 0^ 2.3042 -0.5542 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1208 -2.4792 0.0000 C 0 0 3 0 0 0 0 0 0^ 1.4417 1.0125 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5250 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.3042 0.4708 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5250 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4542 2.0833 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.1708 -2.0042 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3958 -1.0292 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4042 2.5708 0.0000 N 0 0 0 0 0 0 0 0 0^ 2.6125 2.0833 0.0000 C 0 0 2 0 0 0 0 0 0^ -1.3208 -2.5542 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1708 -0.9792 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.7417 -0.2042 0.0000 F 0 0 0 0 0 0 0 0 0^ 4.1167 -1.6167 0.0000 F 0 0 0 0 0 0 0 0 0^ 2.6792 -1.9917 0.0000 F 0 0 0 0 0 0 0 0 0^ -1.2708 -0.4750 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3958 -2.0417 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.6083 -1.5250 0.0000 F 0 0 0 0 0 0 0 0 0^ -2.6625 -3.4000 0.0000 F 0 0 0 0 0 0 0 0 0^ -4.0625 -2.9375 0.0000 F 0 0 0 0 0 0 0 0 0^ 1.4542 3.4458 0.0000 O 0 0 0 0 0 0 0 0 0^ 4.1792 2.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.6125 1.3458 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.1792 1.3208 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4792 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0542 2.0833 0.0000 H 0 0 0 0 0 0 0 0 0^ 2.6125 3.4833 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 3 1 0 0 0^ 3 1 1 0 0 0^ 4 10 1 0 0 0^ 5 8 2 0 0 0^ 6 1 2 0 0 0^ 7 3 2 0 0 0^ 8 6 1 0 0 0^ 9 5 1 0 0 0^ 10 14 1 0 0 0^ 11 6 1 0 0 0^ 12 13 1 0 0 0^ 13 9 1 0 0 0^ 14 20 2 0 0 0^ 15 19 1 0 0 0^ 16 2 1 0 0 0^ 17 2 1 0 0 0^ 18 2 1 0 0 0^ 19 11 2 0 0 0^ 20 11 1 0 0 0^ 21 4 1 0 0 0^ 22 4 1 0 0 0^ 23 4 1 0 0 0^ 9 24 1 1 0 0^ 25 12 1 0 0 0^ 26 13 1 0 0 0^ 27 28 1 0 0 0^ 28 26 1 0 0 0^ 9 29 1 6 0 0^ 13 30 1 1 0 0^ 5 7 1 0 0 0^ 10 15 2 0 0 0^ 27 25 1 0 0 0^M END^^
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