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Compound InformationSONAR Target prediction
Name:

DACTINOMYCIN

Unique Identifier:SPE00330001
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
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
Class:macrolide
Source:Actinomyces spp
Therapeutics:antineoplastic, intercalating agent

Found: 66 active | as graph: single | with analogs 2 3 4 5 6 7 8 9 10  Next >> [66]
Species: 4932
Condition: pdr_yCG196
Replicates: 2
Raw OD Value: r im 0.4470±0.0212132
Normalized OD Score: sc h 0.5970±0.0296767
Z-Score: -13.4740±0.890252
p-Value: 4.61754e-38
Z-Factor: 0.635116
Fitness Defect: 85.9684
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:1|E2
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.0885±0.00760
Plate DMSO Control (-):0.9339999999999999±0.01812
Plate Z-Factor:0.9212
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DBLink | Rows returned: 1
2019 2-amino-4,6-dimethyl-3-oxo-N,N--bis(7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-dipropan-2-yl-8-oxa-1,4,
11,14-tetrazabicyclo[14.3.0]nonadec-6-yl)phenoxazine-1,9-dicarboxamide

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 1492 | Additional Members: 3 | Rows returned: 1
LAT002G11 0

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