Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: PROTERGURIDE
Compound Identifier: 703234
Mol Structure 2D: 703234
Molecular Weight: 369
Formula: C22 H32 N4 O
Development Status: Clinical, Phase I
SMILES: CCCN1CC(CC2C1Cc3c[nH]c4cccc2c34)NC(=O)N(CC)CC
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223132D 0 0.00000 0.00000 0^^ 30 33 0 1 0 999 V2000^ -2.0708 -2.9292 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9208 -0.9792 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.4583 -1.9542 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.0583 -0.9792 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6667 -1.9542 0.0000 N 0 0 3 0 0 0 0 0 0^ -2.6250 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.9750 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9500 -2.9292 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1083 -3.5917 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.1125 -2.9500 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.9375 -0.2667 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.6667 -0.1167 0.0000 C 0 0 2 0 0 0 0 0 0^ -3.7208 -1.9542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.2042 -1.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4083 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7042 1.7500 0.0000 N 0 0 3 0 0 0 0 0 0^ 4.1750 0.5708 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.5833 -0.0417 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4167 -2.6625 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.7583 -0.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.2708 -0.9667 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.5417 2.5333 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.6250 2.0708 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4792 -2.3625 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3292 3.5958 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1917 3.4208 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2750 -3.1292 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.4458 0.2583 0.0000 H 0 0 0 0 0 0 0 0 0^ 0.2292 -3.2792 0.0000 H 0 0 0 0 0 0 0 0 0^ 0.7542 1.1375 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 3 1 0 0 0^ 3 8 1 0 0 0^ 4 6 1 0 0 0^ 5 3 1 0 0 0^ 6 1 1 0 0 0^ 7 11 1 0 0 0^ 8 1 1 0 0 0^ 9 1 2 0 0 0^ 10 9 1 0 0 0^ 12 11 1 6 0 0^ 12 14 1 0 0 0^ 13 6 2 0 0 0^ 14 5 1 0 0 0^ 15 2 1 0 0 0^ 16 7 1 0 0 0^ 17 7 2 0 0 0^ 18 4 2 0 0 0^ 19 5 1 0 0 0^ 20 21 2 0 0 0^ 21 13 1 0 0 0^ 22 16 1 0 0 0^ 23 16 1 0 0 0^ 24 19 1 0 0 0^ 25 22 1 0 0 0^ 26 23 1 0 0 0^ 27 24 1 0 0 0^ 2 28 1 6 0 0^ 3 29 1 1 0 0^ 12 30 1 1 0 0^ 10 13 1 0 0 0^ 4 2 1 0 0 0^ 12 15 1 0 0 0^ 20 18 1 0 0 0^M END^^
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