General Information of the Compound
Compound ID
CP0329408
Compound Name
(R)-5-(6-cyclohexyl-1-(hydroxyamino)-1-oxohexan-3-yl)-N-(cyclopropylmethyl)-1,2,4-oxadiazole-3-carboxamide
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Structure
Formula
C19H30N4O4
Molecular Weight
378.473
Canonical SMILES
ONC(=O)C[C@@H](CCCC1CCCCC1)c1nc(no1)C(=O)NCC1CC1
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InChI
InChI=1S/C19H30N4O4/c24-16(22-26)11-15(8-4-7-13-5-2-1-3-6-13)19-21-17(23-27-19)18(25)20-12-14-9-10-14/h13-15,26H,1-12H2,(H,20,25)(H,22,24)/t15-/m1/s1
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InChIKey
SJSLPFGXTJRLHN-OAHLLOKOSA-N
Physicochemical Property
logP
2.9391
Rotatable Bonds
10
Heavy Atom Count
27
Polar Areas
117.35
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
6
Complexity
27

"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: 9969928
SID: 14947026
ChEMBL ID
CHEMBL520087
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 = 33 nM
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