General Information of the Compound
| Compound ID |
CP0846186
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| Compound Name |
3-({2-[2-(10H-Phenothiazin-10-yl)ethoxy]ethyl}amino)propanoic acid
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| Structure |
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| Formula |
C19H22N2O3S
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| Molecular Weight |
358.463
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| Canonical SMILES |
O=C(O)CCNCCOCCN1c2ccccc2Sc2ccccc21
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| InChI |
InChI=1S/C19H22N2O3S/c22-19(23)9-10-20-11-13-24-14-12-21-15-5-1-3-7-17(15)25-18-8-4-2-6-16(18)21/h1-8,20H,9-14H2,(H,22,23)
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| InChIKey |
SUXKPJVVZARYPS-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