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Compound InformationSONAR Target prediction
Name:

HEXYLRESORCINOL

Unique Identifier:SPE01500330
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:176.127 g/mol
X log p:6.379  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:5
Canonical Smiles:CCCCCCc1ccc(O)cc1O
Source:synthetic
Therapeutics:anthelmintic, topical antiseptic

Found: 436 nonactive | as graph: single | with analogs [1] << Back 401 402 403 404 405 406 407 408 409 410  Next >> [436]
Species: 4932
Condition: NAT1
Replicates: 2
Raw OD Value: r im 0.6889±0.00707107
Normalized OD Score: sc h 0.9735±0.00436966
Z-Score: -1.5683±0.208766
p-Value: 0.120791
Z-Factor: -2.19966
Fitness Defect: 2.1137
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:18|D9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.60 Celcius
Date:2008-06-26 YYYY-MM-DD
Plate CH Control (+):0.0406±0.00066
Plate DMSO Control (-):0.697925±0.01352
Plate Z-Factor:0.9383
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DBLink | Rows returned: 2
3610 4-hexylbenzene-1,3-diol
75055 4-cyclohexylbenzene-1,3-diol

internal high similarity DBLink | Rows returned: 0

active | Cluster 7311 | Additional Members: 1 | Rows returned: 0

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