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Compound InformationSONAR Target prediction
Name:

Dactinomycin

Unique Identifier:LAT002G11
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C64H88N10O16
Molecular Weight:1164.74 g/mol
X log p:0.0749999999999996  (online calculus)
Lipinksi Failures1
TPSA274.92
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:26
Rotatable Bond Count:10
Canonical Smiles:CC(C)C1NC(=O)C(NC(=O)c2ccc(C)c3Oc4c(C)c(=O)c(N)c(C(=O)NC5C(C)OC(=O)C(C
(C)C)N(C)C(=O)CN(C)C(=O)C6CCCC6C(=O)C(NC5=O)C(C)C)c4=Nc32)C(C)OC(=O)C(
C(C)C)N(C)C(=O)CN(C)C(=O)C2CCCC2C1=O

Found: 4 nonactive | as graph: single | with analogs 1 2 3 4 Next >> 
Species: 4932
Condition: pdr22h
Replicates: 2
Raw OD Value: r im 0.6309±0.019304
Normalized OD Score: sc h 0.9156±0.014676
Z-Score: -3.2035±0.0680348
p-Value: 0.00137509
Z-Factor: 0.173143
Fitness Defect: 6.5892
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:2|G11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040625±0.00276
Plate DMSO Control (-):0.6738±0.00616
Plate Z-Factor:0.9618
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 1492 | Additional Members: 3 | Rows returned: 1
SPE00330001 0

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