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Compound InformationSONAR Target prediction
Name:

1-Aminocyclopropanecarboxylic acid hydrochloride

Unique Identifier:LOPAC 00644
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C4ClH8NO2
Molecular Weight:129.501 g/mol
X log p:-2.117  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:Cl.NC1(CC1)C(O)=O
Class:Glutamate
Action:Agonist
Selectivity:NMDA-Glycine
Generic_name:1-AMINOCYCLOPROPANECARBOXYLIC ACID
Chemical_iupac_name:1-AMINOCYCLOPROPANECARBOXYLIC ACID
Drug_type:Experimental
Drugbank_id:EXPT00065
Drug_category:1-Aminocyclopropane-1-Carboxylate Deaminase inhibitor
Organisms_affected:-1

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: CIN2
Replicates: 2
Raw OD Value: r im 0.8335±0.00445477
Normalized OD Score: sc h 0.9948±0.0020291
Z-Score: -0.3888±0.115399
p-Value: 0.698368
Z-Factor: -4.93663
Fitness Defect: 0.359
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|H3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.00 Celcius
Date:2005-12-07 YYYY-MM-DD
Plate CH Control (+):0.039175±0.00129
Plate DMSO Control (-):0.81145±0.01249
Plate Z-Factor:0.9410
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DBLink | Rows returned: 511 2 3 4 5 6 7 8 9 Next >> 
535 1-aminocyclopropane-1-carboxylic acid
1182 2-amino-3-methyl-butanoic acid
6287 (2S)-2-amino-3-methyl-butanoic acid
6657 2-aminobutanoic acid
34090 2-amino-3-methyl-butanoate; cobalt(+2) cation; trihydrate
71563 (2R)-2-amino-3-methyl-butanoic acid

internal high similarity DBLink | Rows returned: 1
SPE01502130 1.0000

active | Cluster 4858 | Additional Members: 8 | Rows returned: 1
SPE01502131 0.2

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