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Compound InformationSONAR Target prediction
Name:

COLCHICINE

Unique Identifier:SPE01500205
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:374.239 g/mol
X log p:9.286  (online calculus)
Lipinksi Failures1
TPSA71.06
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:6
Canonical Smiles:COC1=CC=C2C(=CC1=O)C(CCc1cc(OC)c(OC)c(OC)c12)NC(C)=O
Class:alkaloid
Source:Colchicum autumnale
Reference:J Am Chem Soc 74: 487 (1952)
Therapeutics:antimitotic, antigout agent

Found: 205 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [205]
Species: 4932
Condition: NPR1
Replicates: 2
Raw OD Value: r im 1.0109±0.0170413
Normalized OD Score: sc h 0.9898±0.00375644
Z-Score: 1.0525±0.29409
p-Value: 0.302924
Z-Factor: -8.74034
Fitness Defect: 1.1943
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:1|G9
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0081±0.00469
Plate DMSO Control (-):1.0006249999999999±0.02736
Plate Z-Factor:0.9248
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DBLink | Rows returned: 71 2 Next >> 
2833
6167
23758
53278
450692
537229

internal high similarity DBLink | Rows returned: 3
SPE01800067 0.9440
BTB 12749 1.0000
LOPAC 00810 1.0000

active | Cluster 2172 | Additional Members: 11 | Rows returned: 3
Prest353 0.493506493506494
Prest875 0.386363636363636
SPE01800067 0.217391304347826

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