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BDBM50005773 (+/-)-Propyl-carbamic acid 1-ethyl-3a-methyl-1,2,3,3a,8,8a-hexahydro-1-aza-cyclopenta[a]inden-5-yl ester::CHEMBL32964

SMILES: CCCNC(=O)Oc1ccc2CC3N(CC)CC[C@@]3(C)c2c1

InChI Key: InChIKey=XAWCVUBHVCUDBZ-DAFXYXGESA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50005773   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50005773
PNG
((+/-)-Propyl-carbamic acid 1-ethyl-3a-methyl-1,2,3...)
Show SMILES CCCNC(=O)Oc1ccc2CC3N(CC)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C18H26N2O2/c1-4-9-19-17(21)22-14-7-6-13-11-16-18(3,15(13)12-14)8-10-20(16)5-2/h6-7,12,16H,4-5,8-11H2,1-3H3,(H,19,21)/t16?,18-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 154n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human AchE (Acetylcholinesterase)


J Med Chem 35: 1429-34 (1992)


BindingDB Entry DOI: 10.7270/Q2RN38GQ
More data for this
Ligand-Target Pair