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Compound Report Overview

Compound Name: CR-2945
Compound Identifier: 704189
Mol Structure 2D: 704189
Molecular Weight: 527
Formula: C33 H38 N2 O4
Development Status: Clinical, Phase I
SMILES: Cc1cc(C)c(NC(=O)CC(CC(=O)O)c2cccc3ccccc23)c(c1)C(=O)N4CCC5(CCCC5)CC4
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223272D 0 0.00000 0.00000 0^^ 39 43 0 1 0 999 V2000^ -1.3083 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3083 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6500 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9958 -1.5375 0.0000 N 0 0 3 0 0 0 0 0 0^ 2.0042 0.0208 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.0000 1.2625 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0042 -0.3542 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.6792 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6500 0.7958 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.6542 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9833 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3375 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3375 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.6667 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6458 -1.5375 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.3083 1.1708 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6625 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9833 -2.3167 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.3333 -2.3167 0.0000 C 0 0 3 0 0 0 0 0 0^ -1.9833 0.7958 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6792 0.8083 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.3375 0.7958 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.6542 2.3958 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.3333 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6625 -2.7042 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.0000 -0.3417 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.3375 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.0458 1.2583 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3042 1.2583 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3375 2.3958 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.0500 -1.9917 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.4083 -3.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.0000 2.7833 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6625 1.1833 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3292 2.7708 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9792 1.6208 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.5833 -2.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.1833 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9917 2.3833 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 2 0 0 0^ 4 2 1 0 0 0^ 5 12 1 0 0 0^ 5 6 1 1 0 0^ 7 3 1 0 0 0^ 8 7 1 0 0 0^ 9 3 1 0 0 0^ 10 6 1 0 0 0^ 11 1 1 0 0 0^ 12 8 1 0 0 0^ 13 14 1 0 0 0^ 14 5 1 0 0 0^ 15 2 2 0 0 0^ 16 20 1 0 0 0^ 17 4 1 0 0 0^ 18 4 1 0 0 0^ 19 25 1 0 0 0^ 20 11 2 0 0 0^ 21 8 2 0 0 0^ 22 13 2 0 0 0^ 23 10 1 0 0 0^ 24 17 1 0 0 0^ 25 18 1 0 0 0^ 26 13 1 0 0 0^ 27 6 2 0 0 0^ 28 9 1 0 0 0^ 29 10 2 0 0 0^ 30 27 1 0 0 0^ 31 19 1 0 0 0^ 32 19 1 0 0 0^ 33 30 2 0 0 0^ 34 20 1 0 0 0^ 35 23 2 0 0 0^ 36 29 1 0 0 0^ 37 31 1 0 0 0^ 38 32 1 0 0 0^ 39 36 2 0 0 0^ 16 9 2 0 0 0^ 24 19 1 0 0 0^ 37 38 1 0 0 0^ 33 23 1 0 0 0^ 39 35 1 0 0 0^M END^^
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