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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 91 92 93 94 95 96 97 98 99 100  Next >> [114]
Species: 4932
Condition: TIF3
Replicates: 2
Raw OD Value: r im 0.6200±0.00148492
Normalized OD Score: sc h 1.0065±0.00486923
Z-Score: 0.3030±0.219878
p-Value: 0.764698
Z-Factor: -7.79017
Fitness Defect: 0.2683
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.30 Celcius
Date:2007-10-31 YYYY-MM-DD
Plate CH Control (+):0.04205±0.00043
Plate DMSO Control (-):0.6098250000000001±0.01418
Plate Z-Factor:0.9122
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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

active | Cluster 4140 | Additional Members: 3 | Rows returned: 0

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