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
32891-06-0277missingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissinginactiveactiveinactiveactiveinactivemissingmissingmissingmissingmissingmissinginactivemissingmissingmissingactive
507CCN(CCO)CCInChI=1S/C6H15NO/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H32-Diethylaminoethanolmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing
650N(CCO)CCOInChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2Diethanolaminemissingactivemissinginactivemissingmissingmissingmissingmissingmissingmissingmissingmissingactiveactivemissingactivemissingmissingmissingmissingmissinginactivemissingmissingmissingmissingmissing