General Information of the Compound
| Compound ID |
CP0508206
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| Compound Name |
2-benzyl-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrole
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| Structure |
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| Formula |
C18H19NO
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| Molecular Weight |
265.356
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| Canonical SMILES |
C(N1CC2COc3ccccc3C2C1)c1ccccc1
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| InChI |
InChI=1S/C18H19NO/c1-2-6-14(7-3-1)10-19-11-15-13-20-18-9-5-4-8-16(18)17(15)12-19/h1-9,15,17H,10-13H2
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| InChIKey |
JZKQROSAHVWKPB-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