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Compound InformationSONAR Target prediction
Name:

PUTRESCINE DIHYDROCHLORIDE

Unique Identifier:SPE01503952
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C4Cl2H14N2
Molecular Weight:146.962 g/mol
X log p:-1.132  (online calculus)
Lipinksi Failures0
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:3
Canonical Smiles:Cl.Cl.NCCCCN
Source:ex catabolism of ornithine
Therapeutics:ornithine decarboxylase inhibitor, cell growth factor
Generic_name:PUTRESCINE
Chemical_iupac_name:1,4-DIAMINOBUTANE
Drug_type:Experimental
Kegg_compound_id:C00134
Drugbank_id:EXPT02702
Logp:-0.584
Cas_registry_number:110-60-1
Drug_category:S-Adenosylmethionine Decarboxylase Proenzyme inhibitor
Organisms_affected:-1

Found: 114 nonactive as graph: single | with analogs [1] << Back 61 62 63 64 65 66 67 68 69 70  Next >> [114]
Species: 4932
Condition: NUP100
Replicates: 2
Raw OD Value: r im 0.7233±0.0142836
Normalized OD Score: sc h 0.9987±0.000825013
Z-Score: -0.0878±0.0556684
p-Value: 0.93011
Z-Factor: -42.143
Fitness Defect: 0.0725
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.90 Celcius
Date:2007-08-28 YYYY-MM-DD
Plate CH Control (+):0.041275000000000006±0.00065
Plate DMSO Control (-):0.708375±0.01920
Plate Z-Factor:0.9035
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DBLink | Rows returned: 112 Next >> 
1045 butane-1,4-diamine
9532 butane-1,4-diamine dihydrochloride
60408 (2R)-2-methylbutane-1,4-diamine
193504 2-methylbutane-1,4-diamine
444372 azane; butane-1,4-diamine; platinum
450536 butane-1,4-diamine

internal high similarity DBLink | Rows returned: 1
LOPAC 01154 1.0000

nonactive | Cluster 4140 | Additional Members: 3 | Rows returned: 2
LOPAC 00361 0.416666666666667
LOPAC 01154 0

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