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
11289-04-0218missingmissingmissingmissingmissinginactivemissingactiveinactivemissingmissingmissingmissingmissingactivemissinginactivemissinginactivemissingmissingmissinginactivemissingmissingmissingmissingmissing
225Oc1c(cc(cc1)Cl)ClInChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H2,4-Dichlorophenolmissinginactiveinactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing
231Clc1cc(ccc1)ClInChI=1S/C6H4Cl2/c7-5-2-1-3-6(8)4-5/h1-4H1,3-Dichlorobenzenemissinginactivemissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingactiveinactiveactiveactivemissingmissingmissingmissingmissinginactivemissingmissingmissingactiveinactive
427Clc1c(cccc1)ClInChI=1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H1,2-Dichlorobenzenemissinginactivemissinginactivemissinginactivemissinginactiveinactiveactivemissingmissingmissinginactiveactiveinactiveactivemissingmissingmissingmissingmissinginactiveinactiveinactiveinactivemissinginactive
627c1c(Cl)ccc(c1Cl)OCC(O)=OInChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)2,4-Dichlorophenoxyacetic acidmissingactiveinactivemissingmissingmissingmissinginactivemissingactivemissingmissingmissingmissingactiveinactiveactivemissingmissingmissinginactivemissinginactiveinactiveinactivemissingactiveinactive
641Clc1ccc(cc1)ClInChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4Hp-Dichlorobenzenemissinginactiveinactivemissingmissinginactiveinactivemissingmissingmissingmissingmissinginactiveinactiveinactiveinactiveinactivemissingmissingmissingmissingmissinginactiveinactivemissingmissingmissingmissing
688Cc1c(ccc(Cl)c1)OInChI=1S/C7H7ClO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H34-Chloro-o-cresolmissingmissingmissingmissingmissingmissinginactivemissingmissingmissinginactivemissingmissingmissingmissingmissinginactivemissingmissingmissingmissingmissinginactivemissingmissingmissingmissinginactive
73000-06-1427missingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissinginactivemissingmissingmissingmissing