General Information of the Compound
| Compound ID |
CP0467385
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| Compound Name |
7-N,7-N-dipropyl-7,8-dihydro-6H-pyrano[2,3-e][1,3]benzothiazole-2,7-diamine
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| Structure |
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| Formula |
C16H23N3OS
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| Molecular Weight |
305.447
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| Canonical SMILES |
CCCN(CCC)C1COc2c(C1)ccc1sc(N)nc21
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| InChI |
InChI=1S/C16H23N3OS/c1-3-7-19(8-4-2)12-9-11-5-6-13-14(15(11)20-10-12)18-16(17)21-13/h5-6,12H,3-4,7-10H2,1-2H3,(H2,17,18)
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| InChIKey |
NFIBVHPLILJWFU-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor