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

Compound InformationSONAR Target prediction
Name:

VERATRINE SULFATE

Unique Identifier:SPE00310300
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:639.415 g/mol
X log p:-0.855000000000001  (online calculus)
Lipinksi Failures0
TPSA38.77
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:3
Canonical Smiles:CC=C(C)C(=O)OC1CCC2(C)C3CCC4C5(O)CC(O)C6(O)C(CN7CC(C)CCC7C6(C)O)C5(O)C
C42OC13O.OS(O)(=O)=O
Source:Schoenocaulon officinale; shown as cevadine
Therapeutics:antihypertensive

Found: 590 nonactive | as graph: single | with analogs [1] << Back 571 572 573 574 575 576 577 578 579 580  Next >> [590]
Species: 4932
Condition: SET2
Replicates: 2
Raw OD Value: r im 0.6975±0.00212132
Normalized OD Score: sc h 0.9756±0.00397003
Z-Score: -1.4282±0.238044
p-Value: 0.159029
Z-Factor: -91.6643
Fitness Defect: 1.8387
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:10|C7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2007-11-15 YYYY-MM-DD
Plate CH Control (+):0.041475±0.00082
Plate DMSO Control (-):0.7089749999999999±0.12749
Plate Z-Factor:0.4040
png
ps
pdf

DBLink | Rows returned: 2
5351532
5702002

internal high similarity DBLink | Rows returned: 1
SPE01503815 0.9533

active | Cluster 14579 | Additional Members: 6 | Rows returned: 0
Service provided by the Mike Tyers Laboratory