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Compound InformationSONAR Target prediction
Name:

CAMPHOR (1R)

Unique Identifier:SPE01500156
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:136.106 g/mol
X log p:-0.875  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:0
Canonical Smiles:CC1(C)C2CCC1(C)C(=O)C2
Class:terpene
Source:Cinnamomum camphora
Therapeutics:analgesic, antiinfective, antipruritic
Generic_name:5ALPHA-ANDROSTAN-3,17-DIONE
Chemical_iupac_name:5ALPHA-ANDROSTAN-3,17-DIONE
Drug_type:Experimental
Drugbank_id:EXPT00262
Drug_category:Estradiol 17 Beta-Dehydrogenase 1 inhibitor
Organisms_affected:-1

Found: 205 nonactive as graph: single | with analogs [1] << Back 71 72 73 74 75 76 77 78 79 80  Next >> [205]
Species: 4932
Condition: POP2
Replicates: 2
Raw OD Value: r im 0.6533±0.0186676
Normalized OD Score: sc h 0.9995±0.0133171
Z-Score: -0.0493±0.626434
p-Value: 0.658186
Z-Factor: -18.8447
Fitness Defect: 0.4183
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:9|E9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.90 Celcius
Date:2007-10-24 YYYY-MM-DD
Plate CH Control (+):0.040875±0.00070
Plate DMSO Control (-):0.642925±0.04572
Plate Z-Factor:0.7473
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DBLink | Rows returned: 1448[1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [242]
76877 cyclononanone
77153 cyclotetradecanone
77226 cycloheptadecanone
77961 cycloheptanecarbaldehyde
78070 3-cyclohexylpropanal
78236 nonan-4-one

internal high similarity DBLink | Rows returned: 171 2 3 Next >> 
RJC 02257 0.9231
RJC 02979 0.9231
JFD 02406 0.9231
BTBG 00073 0.9231
BTB 14425 0.9231
BTB 13696 0.9231

active | Cluster 10613 | Additional Members: 2 | Rows returned: 0
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