General Information of the Compound
| Compound ID |
CP0409855
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| Compound Name |
1-[2-(3-chlorophenyl)ethyl]-3-[(3S)-pyrrolidin-3-yl]-1,3-diazinane-2,4,6-trione
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| Structure |
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| Formula |
C16H18ClN3O3
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| Molecular Weight |
335.791
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| Canonical SMILES |
Clc1cccc(CCN2C(=O)CC(=O)N([C@H]3CCNC3)C2=O)c1
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| InChI |
InChI=1S/C16H18ClN3O3/c17-12-3-1-2-11(8-12)5-7-19-14(21)9-15(22)20(16(19)23)13-4-6-18-10-13/h1-3,8,13,18H,4-7,9-10H2/t13-/m0/s1
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| InChIKey |
WCCAYVRPEVXFAI-ZDUSSCGKSA-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: PT06040, Voltage-dependent L-type calcium channel subunit alpha-1C
Protein ID: PT06039, Voltage-dependent L-type calcium channel subunit alpha-1D