Chelist Moleculee
JRC CODE:JRC-000078
cas:549-18-8
einecs:208-964-6
smiles:Cl.CN(C)CC\C=C1/c2ccccc2CCc3ccccc13
name:Amitriptyline Hydrochloride
component:50-48-6
MW:313.864
formula:C20H24ClN
InChi:
InChiKey:
SMARTS:
Other names
1-Propanamine, 3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethyl-, hydrochloride (1:1)
1-Propanamine, 3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethyl-, hydrochloride (9CI)
5H-Dibenzo[a,d]cycloheptene-Δ5,γ-propylamine, 10,11-dihydro-N,N-dimethyl-, hydrochloride (6CI,8CI)
10,11-Dihydro-N,N-dimethyl-5H-dibenzo[a,d]cycloheptene-Δ5,γ-propylamine hydrochloride
5-(3-Dimethylaminopropylidene)dibenzo[a,d][1,4]cycloheptadiene hydrochloride
Adepril
Amicen
Amil 25
Amilent
Amilit
Amineurin
Amiplin
Amiprin
Amitid
Amitril
Amitrip
Amitriptyline chloride
Amitriptyline hydrochloride
Amyline
Amyzol
Anapsique
Apo-Amitriptyline
Damilen hydrochloride
Deprex
Domical
Elatrol
Elatrolet
Elavil
Enafon
Endep
Etravil
Euplit
Lantron
Laroxyl
Larozyl
Lentizol
Miketorin
NIH 10794
Noriline
Novoprotect
Pinsanu
Pinsaun
Redomex
Ro 4-1575
Saroten
Saroten Retard
Sarotena
Sarotex
Sylvemid
Syneudon
Teperin
Trepiline
Tridep
Tripta
Triptizol
Trynol
Tryptal
Tryptanol
Tryptine
Tryptizol
Trytomer
Uxen
Vanatrip

Search by similarity
Tanimoto index:
The algorithm applies nearest neighbor searching that finds molecules similar to the query object. The calculation applies the Tanimoto (or Jaccard) coefficient that is calculated by the following formula in the case of binary fingerprint (bit string) input: T(A,B) = NA&B/(NA+NB-NA&B) where NA and NB are the number of bits set in the bit strings of molecules A and B, respectively, NA&B is the number of bits that are set in both.

Inventory List where this chemical is present

NICEATM ECVAM 3T3NRU CITOTOXICITY (72): Reference chemicals used in the NICEATM/ECVAM validation study of the Neutral Red Uptake (NRU) basal cytotoxicity assay (Method Validation)
ACuteTox (124): Reference chemicals used in the FP6 Integrated Project ACuteTox (EU Research Projects)
TOXCAST PHASE II (535): US EPA ToxCast list - phase II (International Research Projects)
TOX21 LIST1 (8205): Tox21 Chemical Inventory for High-Throughput Screening (International Research Projects)
REACH PRS (143835): ECHA list of pre-registered substances (Regulatory)
NTP CYTOTOX (1353): Compound Cytotoxicity Profiling Using Quantitative High-Throughput Screening (International Research Projects)
Japanese TGx project (132): TG-GATEs (Genomics-Assisted Toxicity Evaluation System developed by the Toxicogenomics Project in Japan) (International Research Projects)