Home | Screening data | Screen comparisons | Search for compounds | Structure search

Compound InformationSONAR Target prediction
Name:

DESMETHYLDIHYDROCAPSAICIN

Unique Identifier:SPE02300192
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:266.187 g/mol
X log p:6.381  (online calculus)
Lipinksi Failures2
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:11
Canonical Smiles:CCCCCCCCC(=O)NCc1ccc(O)c(OC)c1
Source:synthetic
Therapeutics:analgesic (topical), depletes Substance P

Found: 205 nonactive as graph: single | with analogs [1] << Back 41 42 43 44 45 46 47 48 49 50  Next >> [205]
Species: 4932
Condition: MSO1
Replicates: 2
Raw OD Value: r im 0.7396±0.0183141
Normalized OD Score: sc h 1.0169±0.0235681
Z-Score: 0.8488±1.19302
p-Value: 0.543218
Z-Factor: -5.73136
Fitness Defect: 0.6102
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:12|C10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.80 Celcius
Date:2008-02-27 YYYY-MM-DD
Plate CH Control (+):0.041275±0.00046
Plate DMSO Control (-):0.700225±0.01560
Plate Z-Factor:0.9215
png
ps
pdf

DBLink | Rows returned: 141 2 3 Next >> 
2998 N-[(4-hydroxy-3-methoxy-phenyl)methyl]nonanamide
97030 N-[(4-hydroxy-3-methoxy-phenyl)methyl]heptanamide
107982 N-[(4-hydroxy-3-methoxy-phenyl)methyl]-8-methyl-nonanamide
168836 N-[(4-hydroxy-3-methoxy-phenyl)methyl]-7-methyl-octanamide
169252 N-[(4-hydroxy-3-methoxy-phenyl)methyl]decanamide
206278 N-[(4-hydroxy-3-methoxy-phenyl)methyl]undecanamide

internal high similarity DBLink | Rows returned: 2
LOPAC 01026 1.0000
LOPAC 01291 1.0000

nonactive | Cluster 16111 | Additional Members: 9 | Rows returned: 5
LOPAC 01216 0.528571428571429
Prest204 0.338709677419355
SPE01501128 0.338709677419355
LOPAC 01026 0.245614035087719
LOPAC 01291 0

Service provided by the Mike Tyers Laboratory