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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 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.7852±0.160096
Normalized OD Score: sc h 0.9718±0.0321983
Z-Score: -0.9678±1.15329
p-Value: 0.278698
Z-Factor: -60.9941
Fitness Defect: 1.2776
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|H3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.60 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.04716875000000002±0.00193
Plate DMSO Control (-):0.7670249999999997±0.04497
Plate Z-Factor:0.7866
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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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