General Information of the Compound
| Compound ID |
CP0400225
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| Compound Name |
3-(3-fluoropropyl)-N-[[(2S)-1-prop-2-enylpyrrolidin-2-yl]methyl]benzamide
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| Structure |
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| Formula |
C18H25FN2O
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| Molecular Weight |
304.409
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| Canonical SMILES |
FCCCc1cccc(c1)C(=O)NC[C@@H]1CCCN1CC=C
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| InChI |
InChI=1S/C18H25FN2O/c1-2-11-21-12-5-9-17(21)14-20-18(22)16-8-3-6-15(13-16)7-4-10-19/h2-3,6,8,13,17H,1,4-5,7,9-12,14H2,(H,20,22)/t17-/m0/s1
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| InChIKey |
PFVOHXHHGRINAB-KRWDZBQOSA-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