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Compound InformationSONAR Target prediction
Name:

MENTHOL(-)

Unique Identifier:SPE01503134
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:136.106 g/mol
X log p:-0.347  (online calculus)
Lipinksi Failures0
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:1
Canonical Smiles:CC(C)C1CCC(C)CC1O
Class:terpene
Source:Mentha piperita and other Mentha spp
Therapeutics:analgesic (topical), antipruritic agent
Generic_name:5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL
Chemical_iupac_name:5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL
Drug_type:Experimental
Drugbank_id:EXPT00530
Logp:3.73
Drug_category:Sex Hormone-Binding Globulin inhibitor
Organisms_affected:-1

Found: 205 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [205]
Species: 4932
Condition: TOR1
Replicates: 2
Raw OD Value: r im 0.9422±0.0156978
Normalized OD Score: sc h 0.9425±0.0171333
Z-Score: -0.4192±0.456327
p-Value: 0.690666
Z-Factor: -1.11129
Fitness Defect: 0.3701
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:1|B3
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0014750000000000002±0.00465
Plate DMSO Control (-):0.995525±0.02638
Plate Z-Factor:0.8881
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DBLink | Rows returned: 2037[1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [340]
15818 (3R,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclope
nta[a]phenanthrene-3,17-diol
16021 1-ethylcyclohexan-1-ol
16071 bicyclo[3.2.1]octan-2-ol
16320 decan-4-ol
16666 (1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexan-1-ol
16913 1,2,7,7-tetramethylnorbornan-2-ol

internal high similarity DBLink | Rows returned: 382 3 4 5 6 7 Next >> 
BTB 12413 0.9231
RJC 00940 0.9231
JFD 01247 0.9231
NRB 02212 0.9231
BTB 14986 0.9231
BTB 14459 0.9231

active | Cluster 4541 | Additional Members: 2 | Rows returned: 0

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