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
10898-04-1051missingactivemissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingmissingactivemissingactivemissingmissingmissingmissingmissingmissingmissingactiveactivemissingmissing
17994-06-0592missingactivemissingmissingmissingmissingmissingmissingactivemissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactiveactivemissingmissingmissingmissing
27799-03-0434inactiveactivemissingmissingmissingmissinginactivemissingactiveinactivemissingactivemissingmissingmissingactiveinactivemissingmissingmissingmissingmissingactiveinactivemissingmissingmissingactive
308CC1(CC(CC(C1)(C)CN=C=O)N=C=O)CInChI=1S/C12H18N2O2/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15/h10H,4-7H2,1-3H3Isophorone diisocyanatemissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactive
34095-06-0667inactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactiveactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing
35296-03-0346missingactivemissingmissingactivemissingmissingmissingmissingactiveactivemissingactivemissingmissingactivemissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissing
36997-03-0383missingmissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissing
391N=C(Nc1ccccc1)Nc2ccccc2InChI=1S/C13H13N3/c14-13(15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H,(H3,14,15,16)N,N'-Diphenylguanidinemissingactiveinactivemissingactiveactiveactiveactivemissingactivemissingmissingmissingmissingactiveactivemissinginactivemissinginactiveinactivemissingmissingactiveinactiveactivemissingactive
41399-06-1219missingmissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing
49698-06-1117missingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingactivemissingmissingmissingmissingmissingmissingactivemissingmissingmissingmissingactive
56800-05-0365missinginactiveinactivemissingmissingmissingmissingmissinginactivemissingmissinginactivemissingmissingmissinginactiveinactivemissingmissingmissingmissingmissinginactiveinactivemissingmissingmissingmissing
73901-04-1361missingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissinginactivemissingmissingmissingmissingmissingmissingmissingmissingmissinginactivemissingmissing
74101-04-1419missinginactivemissingactivemissinginactiveactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactiveinactiveinactivemissingmissingmissinginactive
80293-07-0049missingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissingactivemissingactivemissingmissingmissingmissingmissingmissingmissingmissingmissingmissingmissing