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NICEATM ECVAM 3T3NRU CITOTOXICITY: Reference chemicals used in the NICEATM/ECVAM validation study of the Neutral Red Uptake (NRU) basal cytotoxicity assay The NICEATM/ECVAM Validation Study of the Neutral Red Uptake (NRU) basal cytotoxicity assay assessed the accuracy of the standardised in vitro cytotoxicity test methods for estimating rodent oral LD50 values across the five United Nations Globally Harmonized System of Classification and Labelling of Chemicals categories of acute oral systemic toxicity, as well as unclassified toxicities. 72 chemicals were tested in three laboratories using two standard cell systems: a human cell system (normal human keratinocytes, NHK) and a rodent fibroblast cell line (BALB/3T3). 1 (72 chemicals) download  excel file 
CASEINECSChemical NameSMILES
10043-35-3 233-139-2Boric AcidOB(O)O
10108-64-2 233-296-7Cadmium Chloride[Cd](Cl)Cl
103-85-5 203-151-2Phenyl-2-ThioureaNC(=S)Nc1ccccc1
103-90-2 203-157-5Acetaminophenc1(ccc(cc1)O)NC(=O)C
107-21-1 203-473-3Ethylene glycolOCCO
108-95-2 203-632-7PhenolOc(cccc1)c1
115-29-7 204-079-4EndosulphanClC1=C(Cl)C2(Cl)C3COS(=O)OCC3C1(Cl)C2(Cl)Cl |c:1|
1327-53-3 215-481-4Arsenic Oxide (As2O3)O1[As]2O[As]1O2
1330-20-7 215-535-7Xylenec1(ccccc1)C.C*
13410-01-0 236-501-8Sodium selenate[O-][Se](=O)(=O)[O-].[Na+].[Na+]
151-50-8 205-792-3Potassium Cyanide (K(CN))[K]C#N
152-11-4 205-800-5(±)-Verapamil Hydrochloridec1([C@@](CCC[N@@](CCc2cc(c(OC)cc2)OC)C)(C(C)C)C#N)cc(c(OC)cc1)OC.Cl
1910-42-5 217-615-7Paraquat Dichloridec1(c2cc[n+](C)cc2)cc[n+](C)cc1.[ClH-].[ClH-]
20830-75-5 244-068-1DigoxinC[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@H]1[C@@H](O)C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3CC[C@@]4(C)[C@H](CC[C@@H]5[C@@H]4C[C@@H](O)[C@]4(C)[C@H](CC[C@]54O)C4=CC(=O)OC4)C3)O[C@@H]2C)O[C@@H]1C |t:46|
298-04-4 206-054-3DisulfotonCCOP(=S)(OCC)SCCSCC
298-46-4 206-062-7CarbazepineNC(=O)N1c2ccccc2C=Cc2ccccc12 |c:11|
302-17-0 206-117-5Chloral Hydrate OC(O)C(Cl)(Cl)Cl
318-98-9 206-268-7(±)-Propranolol Hydrochloridec12c(OC[C@@H](CNC(C)C)O)cccc1cccc2.Cl
39515-41-8 254-485-0FenpropathrinCC1(C)C(C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2)C1(C)C
50-06-6 200-007-0PhenobarbitalCCC1(C(=O)NC(=O)NC1(=O))c2ccccc2
50-21-5 200-018-0Lactic AcidC([C@@H](C)O)(O)=O
50-78-2 200-064-1Acetylsalicylic AcidO=C(Oc(c(ccc1)C(=O)O)c1)C
51-18-3 200-083-5TriethylenemelamineC1CN1c1nc(nc(n1)N1CC1)N1CC1
51-42-3 200-097-1Epinephrine Hydrogen TartrateO[C@H]([C@@H](O)C(O)=O)C(O)=O.CNC[C@H](O)C1=CC(O)=C(O)C=C1
52-86-8 200-155-6HaloperidolOC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
54-11-5 200-193-3NicotineCN1CCC[C@H]1C1=CN=CC=C1
54-62-6 200-209-9AminopterinNc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
549-18-8 208-964-6Amitriptyline HydrochlorideCl.CN(C)CC\C=C1/c2ccccc2CCc3ccccc13
55-98-1 200-250-2BusulfanC[S](=O)(=O)OCCCCO[S](C)(=O)=O
554-13-2 209-062-5Lithium CarbonateC(=O)([O-])[O-].[Li+].[Li+]
56-23-5 200-262-8Carbon TetrachlorideClC(Cl)(Cl)Cl
56-38-2 200-271-7ParathionP(Oc1ccc([N+](=O)[O-])cc1)(OCC)(OCC)=S
56-75-7 200-287-4Chloramphenicolc1cc(ccc1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]
56-81-5 200-289-5GlycerolOCC(O)CO
57-24-9 200-319-7Strychnine[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C7=CC=CC=C7[C@@]1(CC[N@]2C4)[C@]6([H])[C@@]35[H]
57-47-6 200-332-8Physostigmine[H][C@]12N(C)CC[C@@]1(C)C1=CC(OC(=O)NC)=CC=C1N2C
57-53-4 200-337-5MeprobamateCCCC(C)(COC(N)=O)COC(N)=O
58-08-2 200-362-1CaffeineO=C1C2=C(N=CN2C)N(C(=O)N1C)C
58-89-9 200-401-2LindaneCl[C@@H]1[C@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H](Cl)[C@H]1Cl
5908-99-6 611-792-8Atropine Sulfate MonohydrateC1[C@@H](C[C@@H]2CC[C@@H]1N2C)OC([C@@H](c1ccccc1)CO)=O.OS(=O)(O)=O.C1[C@@H](C[C@@H]2CC[C@@H]1N2C)OC([C@@H](c1ccccc1)CO)=O.O
614-39-1 210-381-7Procainamide HydrochlorideCl.CCN(CC)CCNC(=O)C1=CC=C(N)C=C1
62-73-7 200-547-7DichlorvosCOP(=O)(OC)OC=C(Cl)Cl
62-76-0 200-550-3Sodium oxalateC(=O)(C(=O)[O-])[O-].[Na+].[Na+]
6385-62-2 Diquat Dibromide Monohydratec1cc2c3[n+](CC[n+]2cc1)cccc3.[BrH-].[BrH-].O
64-17-5 200-578-6EthanolC(C)O
64-86-8 200-598-5ColchicineCOC1=C(OC)C(OC)=C2C(CC[C@H](NC(C)=O)C3=CC(=O)C(OC)=CC=C23)=C1
66-81-9 200-636-0Cicloheximide[H][C@]1(C[C@@H](C)C[C@H](C)C1=O)[C@H](O)CC1CC(=O)NC(=O)C1
67-56-1 200-659-6MethanolOC
67-63-0 200-661-72-PropanolOC(C)C
68-12-2 200-679-5N,N-DimethylformamideO=CN(C)C
70-30-4 200-733-8HexachloropheneOC1=C(Cl)C=C(Cl)C(Cl)=C1CC1=C(Cl)C(Cl)=CC(Cl)=C1O
71-55-6 200-756-31,1,1-TrichloroethaneCC(Cl)(Cl)Cl
7446-18-6 231-201-3Thallium(I) sulfateS(=O)(=O)([O-])[O-].[Tl+].[Tl+]
7447-40-7 231-211-8Potassium Chloride[Cl-].[K+]
7487-94-7 231-299-8 Mercury DichlorideCl[Hg]Cl
75-05-8 200-835-2AcetonitrileCC#N
76-03-9 200-927-2Trichloroacetic acidOC(=O)C(Cl)(Cl)Cl
76-87-9 200-990-6Triphenyltin hydroxideO[Sn](c1ccccc1)(c2ccccc2)c3ccccc3
7647-14-5 231-598-3Sodium Chloride[Na+].[ClH-]
7681-49-4 231-667-8Sodium Fluoride[Na+].[FH-]
7681-52-9 231-668-3Sodium Hypochlorite[Na+].[O-]Cl
77-06-5 201-001-0Gibberellic Acid[H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(O)=O)[C@]1([H])[C@@]3(C)[C@@H](O)C=C[C@@]21OC3=O
77-21-4 201-012-0GlutethimideCCC1(CCC(=O)NC1=O)C1=CC=CC=C1
77-92-9 201-069-1Citric AcidO=C(O)C(O)(CC(=O)O)CC(=O)O
7758-99-8 616-477-9Cupric SulfateS(=O)(=O)([O-])[O-].O.O.O.O.O.[Cu+2]
7784-46-5 232-070-5Sodium arsenite[As](=O)[O-].[Na+]
7789-12-0 616-541-6Sodium dichromate dihydrate[O-][Cr](=O)(=O)O[Cr]([O-])(=O)=O.[Na+].[Na+].O.O
84-66-2 201-550-6Diethyl PhthalateCCOC(=O)C1=C(C=CC=C1)C(=O)OCC
84-74-2 201-557-4Dibutyl PhthalateCCCCOC(=O)C1=C(C=CC=C1)C(=O)OCCCC
89-57-6 201-919-15-Aminosalicylic acidO=C(O)c(c(O)ccc1N)c1
94-13-3 202-307-7PropylparabenO=C(OCCC)c(ccc(O)c1)c1
99-66-1 202-777-3Valproic AcidC(CCC)(CCC)C(O)=O
Records:1:72