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Compound InformationSONAR Target prediction
Name:

Amiprilose hydrochloride

Unique Identifier:LOPAC 00658
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C14ClH28NO6
Molecular Weight:313.606 g/mol
X log p:-0.87  (online calculus)
Lipinksi Failures0
TPSA40.16
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:7
Canonical Smiles:Cl.CN(C)CCCOC1C(OC2OC(C)(C)OC21)C(O)CO
Class:Immune System
Action:Modulator

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 Next >> [24]
Species: 4932
Condition: WHI3
Replicates: 2
Raw OD Value: r im 0.7283±0.019799
Normalized OD Score: sc h 1.0293±0.0341606
Z-Score: 1.3194±1.63698
p-Value: 0.442342
Z-Factor: -4.48051
Fitness Defect: 0.8157
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|E8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.045475±0.00112
Plate DMSO Control (-):0.679375±0.02217
Plate Z-Factor:0.8765
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DBLink | Rows returned: 12<< Back 1 2
5702213 1-[(3R,4S,5R)-4-(3-dimethylaminopropoxy)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl]ethane-1,2-diol
6420050 1-[(3R,4S,5S)-4-(3-dimethylaminopropoxy)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl]ethane-1,2-diol
hydrochloride
6602490 (1S)-1-[(4S,5S)-4-(3-dimethylaminopropoxy)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl]ethane-1,2-di
ol
6603708 (1R)-1-[(1S,3S,4S,5R)-4-(3-dimethylaminopropoxy)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl]ethane-
1,2-diol
6604419 (1R)-1-[(1S,3R,4R,5S)-4-(3-dimethylaminopropoxy)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl]ethane-
1,2-diol
6713980 1-[(3R,4S,5S)-4-(3-dimethylaminopropoxy)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]oct-3-yl]ethane-1,2-diol

internal high similarity DBLink | Rows returned: 1
SPE01503083 1.0000

active | Cluster 11451 | Additional Members: 4 | Rows returned: 1
SPE01503083 0

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