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

Compound InformationSONAR Target prediction
Name:

BUTAMBEN

Unique Identifier:SPE01500767
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:178.123 g/mol
X log p:7.721  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:5
Canonical Smiles:CCCCOC(=O)c1ccc(N)cc1
Source:synthetic
Therapeutics:anesthetic (local)

Found: 107 active | as graph: single | with analogs [1] << Back 51 52 53 54 55 56 57 58 59 60  Next >> [107]
Species: 4932
Condition: SSE1
Replicates: 2
Raw OD Value: r im 0.3478±0.0125865
Normalized OD Score: sc h 0.7918±0.00762887
Z-Score: -5.6132±0.547777
p-Value: 0.0000000876352
Z-Factor: 0.338164
Fitness Defect: 16.2501
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:4|E2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.30 Celcius
Date:2008-05-01 YYYY-MM-DD
Plate CH Control (+):0.0406±0.00073
Plate DMSO Control (-):0.4094±0.01548
Plate Z-Factor:0.8765
png
ps
pdf

DBLink | Rows returned: 2
2482 butyl 4-aminobenzoate
210327 3-methylbutyl 4-aminobenzoate

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 13501 | Additional Members: 6 | Rows returned: 2
Prest1201 0.333333333333333
Prest994 0

Service provided by the Mike Tyers Laboratory