General Information of the Compound
Compound ID
CP0203299
Compound Name
(R)-6-cyclohexyl-N-hydroxy-3-(3-(piperidine-1-carbonyl)-1,2,4-oxadiazol-5-yl)hexanamide
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Structure
Formula
C20H32N4O4
Molecular Weight
392.5
Canonical SMILES
ONC(=O)C[C@@H](CCCC1CCCCC1)c1nc(no1)C(=O)N1CCCCC1
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InChI
InChI=1S/C20H32N4O4/c25-17(22-27)14-16(11-7-10-15-8-3-1-4-9-15)19-21-18(23-28-19)20(26)24-12-5-2-6-13-24/h15-16,27H,1-14H2,(H,22,25)/t16-/m1/s1
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InChIKey
GIAVIYZYXMFIGR-MRXNPFEDSA-N
Physicochemical Property
logP
3.4254
Rotatable Bonds
8
Heavy Atom Count
28
Polar Areas
108.56
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
6
Complexity
28

"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).

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PubChem ID
CID: 10111132
SID: 15099792
ChEMBL ID
CHEMBL480351
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01896, Bone morphogenetic protein 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 26 nM
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