Viewing Compound With Structures

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Compound Report Overview

Compound Name: RO-23-9424
Compound Identifier: 705909
Mol Structure 2D: 705909
Molecular Weight: 765
Formula: C31 H31 F3 N8 O8 S2
Development Status: Clinical, Phase II/III
SMILES: CON=C(C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)COC(=O)c3cn(CCF)c4c(F)c(N5CCN(C)CC5)c(F)cc4c3=O)c6csc(N)n6
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223112D 0 0.00000 0.00000 0^^ 52 57 0 1 0 999 V2000^ 2.3792 -3.2292 0.0000 N 0 0 3 0 0 0 0 0 0^ 1.4292 -3.2292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4292 -2.4250 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.3792 -2.4167 0.0000 C 0 0 1 0 0 0 0 0 0^ 6.6667 -3.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1000 -3.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1375 -3.6667 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.3792 -2.1917 0.0000 N 0 0 3 0 0 0 0 0 0^ 8.1000 -2.5917 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6083 -2.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.3792 -3.8417 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.8000 -2.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.6667 -2.5917 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.8333 -1.9625 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.4917 -2.5917 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.8958 -3.1875 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.6042 -1.9625 0.0000 N 0 0 0 0 0 0 0 0 0^ -0.1333 -2.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1375 -1.9917 0.0000 S 0 0 0 0 0 0 0 0 0^ 3.8625 -3.2292 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.4917 -3.4167 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7333 -3.1875 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.8000 -3.8417 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.1750 -2.2500 0.0000 N 0 0 3 0 0 0 0 0 0^ 5.9917 -3.7292 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.2958 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.0125 -2.4000 0.0000 S 0 0 0 0 0 0 0 0 0^ 3.1167 -4.4667 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8625 -2.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.6000 -1.3667 0.0000 N 0 0 3 0 0 0 0 0 0^ -0.8333 -1.1750 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.8417 -3.7167 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.2917 -3.3542 0.0000 O 0 0 0 0 0 0 0 0 0^ 4.5917 -3.7292 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.3792 -4.6667 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.1333 -3.0875 0.0000 O 0 0 0 0 0 0 0 0 0^ 10.1750 -1.3667 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.8875 -2.5917 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.9917 -4.5417 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.8000 -1.3667 0.0000 F 0 0 0 0 0 0 0 0 0^ 2.4625 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.3708 -3.7167 0.0000 N 0 0 0 0 0 0 0 0 0^ 10.2000 -3.8417 0.0000 F 0 0 0 0 0 0 0 0 0^ 10.8875 -1.0042 0.0000 C 0 0 0 0 0 0 0 0 0^ 11.6000 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.3792 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8625 -4.8542 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.1500 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.0042 -1.4292 0.0000 F 0 0 0 0 0 0 0 0 0^ 12.3042 -1.0042 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.6792 -1.0042 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.1500 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 4 1 0 0 0^ 4 1 1 0 0 0^ 5 25 1 0 0 0^ 6 11 1 0 0 0^ 7 1 1 0 0 0^ 8 13 1 0 0 0^ 9 8 1 0 0 0^ 10 14 1 0 0 0^ 11 5 1 0 0 0^ 12 9 1 0 0 0^ 13 5 2 0 0 0^ 14 18 1 0 0 0^ 15 12 2 0 0 0^ 16 10 1 0 0 0^ 3 17 1 1 0 0^ 18 17 1 0 0 0^ 4 19 1 1 0 0^ 20 7 2 0 0 0^ 21 23 2 0 0 0^ 22 16 2 0 0 0^ 23 6 1 0 0 0^ 24 15 1 0 0 0^ 25 33 1 0 0 0^ 26 10 2 0 0 0^ 27 26 1 0 0 0^ 28 7 1 0 0 0^ 29 20 1 0 0 0^ 30 45 1 0 0 0^ 31 14 2 0 0 0^ 32 2 2 0 0 0^ 33 34 1 0 0 0^ 34 20 1 0 0 0^ 35 11 2 0 0 0^ 36 18 2 0 0 0^ 37 24 1 0 0 0^ 38 24 1 0 0 0^ 39 25 2 0 0 0^ 40 12 1 0 0 0^ 41 28 2 0 0 0^ 42 22 1 0 0 0^ 43 21 1 0 0 0^ 44 37 1 0 0 0^ 45 38 1 0 0 0^ 46 8 1 0 0 0^ 47 28 1 0 0 0^ 48 31 1 0 0 0^ 49 51 1 0 0 0^ 50 30 1 0 0 0^ 51 46 1 0 0 0^ 52 48 1 0 0 0^ 2 3 1 0 0 0^ 19 29 1 0 0 0^ 27 22 1 0 0 0^ 6 9 2 0 0 0^ 21 15 1 0 0 0^ 44 30 1 0 0 0^M END^^
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