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Compound InformationSONAR Target prediction
Name:

Prochlorperazine dimaleate

Unique Identifier:LOPAC 00300
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C28ClH32N3O8S
Molecular Weight:573.834 g/mol
X log p:16.724  (online calculus)
Lipinksi Failures1
TPSA35.02
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:4
Canonical Smiles:CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1.OC(=O)C=CC(O)=O.OC(=O)C=CC(O)=O
Class:Dopamine
Action:Antagonist

Found: 23 nonactive | as graph: single | with analogs 2 3 4 5 6 7 8 9 10  Next >> [23]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.7473±0.048656
Normalized OD Score: sc h 0.9819±0.0234022
Z-Score: -0.5586±0.63203
p-Value: 0.520056
Z-Factor: -19.5982
Fitness Defect: 0.6538
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:13|H5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.80 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.04800625000000002±0.00227
Plate DMSO Control (-):0.7375000000000003±0.02694
Plate Z-Factor:0.9214
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DBLink | Rows returned: 6
66010 but-2-enedioic acid; 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine
5281032 but-2-enedioic acid; 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine
5462338 but-2-enedioic acid; 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine
5462695 2-chloro-10-[3-(4-methyl-2,3,5,6-tetrahydropyrazin-1-yl)propyl]phenothiazine;
(E)-4-hydroxy-4-oxo-but-2-enoate
6436057 but-2-enedioic acid; 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine
6537213 but-2-enedioic acid; 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine

internal high similarity DBLink | Rows returned: 0

active | Cluster 6041 | Additional Members: 22 | Rows returned: 152 3 Next >> 
LAT002B04 0.5375
SPE01500575 0.5375
Prest437 0.5375
LOPAC 00320 0.5375
Prest1278 0.5
SPE01503936 0.452054794520548

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