General Information of the Compound
| Compound ID |
CP0423116
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| Compound Name |
7-(4-Chloro-phenyl)-7,8,9,10-tetrahydro-7a,11-diaza-benzo[c]fluoren-7-ol
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| Structure |
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| Formula |
C21H17ClN2O
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| Molecular Weight |
348.833
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| Canonical SMILES |
OC1(N2CCCN=C2c2c1ccc1ccccc21)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H17ClN2O/c22-16-9-7-15(8-10-16)21(25)18-11-6-14-4-1-2-5-17(14)19(18)20-23-12-3-13-24(20)21/h1-2,4-11,25H,3,12-13H2
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| InChIKey |
ADCPRYKGPAHETD-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter