Viewing Compound With Structures

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Compound Report Overview

Compound Name: TU-199
Compound Identifier: 703804
Mol Structure 2D: 703804
Molecular Weight: 346
Formula: C16 H18 N4 O3 S
Development Status: Preclinical
SMILES: COc1ccc2[nH]c(nc2n1)S(=O)Cc3ncc(C)c(OC)c3C
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223222D 0 0.00000 0.00000 0^^ 24 26 0 0 0 999 V2000^ 1.1375 0.6708 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.6917 0.0458 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9042 0.4500 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1375 -0.5792 0.0000 N 0 0 0 0 0 0 0 0 0^ -0.0833 0.0458 0.0000 S 0 0 3 0 0 0 0 0 0^ 2.5792 0.8458 0.0000 N 0 0 0 0 0 0 0 0 0^ -1.4625 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1250 0.4333 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9042 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.7625 0.4333 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7958 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.4625 -0.7125 0.0000 N 0 0 0 0 0 0 0 0 0^ -2.7958 -0.7125 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2667 0.4500 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1250 -1.1000 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.2625 -0.7125 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.5792 -0.7375 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2667 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.4625 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.9167 0.8458 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.1250 1.1958 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.4583 -1.0875 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.1208 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.5750 0.4833 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 2 0 0 0^ 3 1 1 0 0 0^ 4 2 1 0 0 0^ 5 2 1 0 0 0^ 6 3 1 0 0 0^ 7 10 1 0 0 0^ 8 7 1 0 0 0^ 9 3 2 0 0 0^ 10 5 1 0 0 0^ 11 8 2 0 0 0^ 12 7 2 0 0 0^ 13 15 2 0 0 0^ 14 6 2 0 0 0^ 15 12 1 0 0 0^ 16 5 2 0 0 0^ 17 9 1 0 0 0^ 18 17 2 0 0 0^ 19 11 1 0 0 0^ 20 14 1 0 0 0^ 21 8 1 0 0 0^ 22 13 1 0 0 0^ 23 19 1 0 0 0^ 24 20 1 0 0 0^ 4 9 1 0 0 0^ 18 14 1 0 0 0^ 13 11 1 0 0 0^M END^^
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