Category

This is a category compound table for model Rat toxicity prediction with Predictive Clustering Trees.

IndexImageSMILESInChInameadrenal-gland-weight-increasedbody-weight-decreasedbone-marrowbrainclinchem-hepatotoxclinchem-nephrotoxcnsfemale-reproductive-organhaematology-anaemiahaematology-cellular-hemostasishaematology-plasmatic-hemostasishaematopoiesisintestinekidneykidney-weight-increasedliverliver-weight-increasedmale-accessory-glandmale-reproductive-organmale-reproductive-organ-spermmale-reproductive-organ-weight-decreasedmale-reproductive-organ-weight-increasedrbcspleenthymusthymus-weight-decreasedthyroid-glandwbc
36796-14-0012missingmissingmissingmissingmissinginactivemissingmissinginactivemissingmissingmissingmissinginactivemissingmissingmissingmissingmissingmissingmissingmissinginactivemissingmissingmissingmissingmissing
45299-04-1211missingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingactivemissinginactivemissingmissingactivemissing
48299-06-1267missingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissinginactiveinactivemissingmissingmissingmissingmissingmissingmissingmissingmissinginactivemissing
553C(CC(OCCCC)=O)(CC(OCCCC)=O)(C(OCCCC)=O)OC(C)=OInChI=1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3Acetyl Tributyl Citratemissingactivemissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissinginactivemissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing
58601-06-1532missingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissinginactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing
690O(CCCCCCCCCCCC)C(=O)CS(=O)(=O)[O-].[Na+]InChI=1S/C14H28O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-19-14(15)13-20(16,17)18;/h2-13H2,1H3,(H,16,17,18);/q;+1/p-1Sodium Lauryl Sulfoacetatemissingactivemissinginactivemissingactiveactivemissingmissingmissingmissingmissingmissingmissinginactivemissinginactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissinginactive
84196-06-0858missingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissinginactiveactivemissinginactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing