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Compound InformationSONAR Target prediction
Name:

1-Amino-1-cyclohexanecarboxylic acid hydrochloride

Unique Identifier:LOPAC 00333
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C7ClH14NO2
Molecular Weight:165.533 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(CCCCC1)C(O)=O
Class:Neurotransmission
Action:Substrate
Generic_name:BETA-CYCLOHEXYL-ALANINE
Chemical_iupac_name:BETA-CYCLOHEXYL-ALANINE
Drug_type:Experimental
Drugbank_id:EXPT01686
Drug_category:Zinc Finger Y-Chromosomal Protein 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: BY4743
Replicates: 2
Raw OD Value: r im 0.8736±0.235962
Normalized OD Score: sc h 0.9952±0.0229438
Z-Score: -0.1451±0.634978
p-Value: 0.656828
Z-Factor: -35.8425
Fitness Defect: 0.4203
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:2|D8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-08-19 YYYY-MM-DD
Plate CH Control (+):0.048875±0.00149
Plate DMSO Control (-):0.80905±0.03564
Plate Z-Factor:0.9097
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DBLink | Rows returned: 1581 2 3 4 5 6 7 8 9 10  Next >> [27]
1366 1-aminocyclohexane-1-carboxylic acid
23378 1-aminocycloheptane-1-carboxylic acid
64354 2-aminoadamantane-2-carboxylic acid
69522 2-aminooctanoic acid
77937 2-aminooctanedioic acid
95194 1-aminocyclooctane-1-carboxylic acid

internal high similarity DBLink | Rows returned: 5
SPE01502026 0.9286
SPE01502128 0.9286
JFD 01160 1.0000
RJC 00670 1.0000
SB 02002 1.0000

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

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