General Information of the Compound
Compound ID
CP0527163
Compound Name
N-(cyclopropylmethyl)-2-methyl-N-propyl-8-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-imidazo[1,2-a]pyrimidine-3-carboxamide
    Show/Hide
Structure
Formula
C24H34N4O
Molecular Weight
394.563
Canonical SMILES
CCCN(CC1CC1)C(=O)c1c(C)nc2N(CCCn12)c1c(C)cc(C)cc1C
    Show/Hide
InChI
InChI=1S/C24H34N4O/c1-6-10-26(15-20-8-9-20)23(29)22-19(5)25-24-27(11-7-12-28(22)24)21-17(3)13-16(2)14-18(21)4/h13-14,20H,6-12,15H2,1-5H3
    Show/Hide
InChIKey
PYVJFPOLHAOSIW-UHFFFAOYSA-N
Physicochemical Property
logP
4.92078
Rotatable Bonds
6
Heavy Atom Count
29
Polar Areas
41.37
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Complexity
29

"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
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 46881386
ChEMBL ID
CHEMBL1083824
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: PT01588, Corticotropin-releasing factor receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000016 IMR-32 Homo sapiens (Human)  1
1
Ki > 5000 nM
   TI
   LI
   LO
   TS