General Information of the Compound
| Compound ID |
CP0847884
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| Compound Name |
(5alpha,8alpha,8aalpha)-4-(octahydro-1,3-dioxo-5,8-methanoimidazo[1,5-a]pyridine-2yl)-1-naphthalenecarbonitrile
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| Structure |
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| Formula |
C19H15N3O2
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| Molecular Weight |
317.348
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| Canonical SMILES |
N#Cc1ccc(N2C(=O)[C@H]3[C@@H]4CC[C@@H](C4)N3C2=O)c2ccccc12
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| InChI |
InChI=1S/C19H15N3O2/c20-10-12-6-8-16(15-4-2-1-3-14(12)15)22-18(23)17-11-5-7-13(9-11)21(17)19(22)24/h1-4,6,8,11,13,17H,5,7,9H2/t11-,13+,17-/m1/s1
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| InChIKey |
GJUHMTILINLNQN-BTJLNZGRSA-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: PT01486, Androgen receptor
Protein ID: PT00894, Androgen receptor