General Information of the Compound
| Compound ID |
CP0441260
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| Compound Name |
N'-(3-fluorophenyl)adamantane-1-carbohydrazide
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| Structure |
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| Formula |
C17H21FN2O
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| Molecular Weight |
288.366
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| Canonical SMILES |
Fc1cccc(NNC(=O)C23CC4CC(CC(C4)C2)C3)c1
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| InChI |
InChI=1S/C17H21FN2O/c18-14-2-1-3-15(7-14)19-20-16(21)17-8-11-4-12(9-17)6-13(5-11)10-17/h1-3,7,11-13,19H,4-6,8-10H2,(H,20,21)
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| InChIKey |
MISBJSARBJEMTI-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: PT01449, P2X purinoceptor 7
Protein ID: PT03917, P2X purinoceptor 7