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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: ARF1
Replicates: 2
Raw OD Value: r im 0.7065±0.00551543
Normalized OD Score: sc h 1.0169±0.00326258
Z-Score: 0.8201±0.155353
p-Value: 0.414956
Z-Factor: -2.86762
Fitness Defect: 0.8796
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:14|C11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.20 Celcius
Date:2007-10-02 YYYY-MM-DD
Plate CH Control (+):0.041025000000000006±0.00095
Plate DMSO Control (-):0.6817±0.01509
Plate Z-Factor:0.9302
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DBLink | Rows returned: 2037[1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [340]
12367 nonan-2-ol
12381 heptane-1,7-diol
12397 pentadecan-1-ol
12404 icosan-1-ol
12620 docosan-1-ol
12766 cyclooctanol

internal high similarity DBLink | Rows returned: 381 2 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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