Chemical ID: 4577858

CC(C)NCC(COc1cccc2c1c(c[nH]2)CC(=O)OC)O
Chemical ID:
4577858
Name [?]:
methyl 2-[4-(2-hydroxy-3-isopropylamino-propoxy)-1H-indol-3-yl]acetate
SMILES [?]:
CC(C)NCC(COc1cccc2c1c(c[nH]2)CC(=O)OC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H24N2O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:7.43544
Area:540.589
Solvation:-6.07929
Coulombic:-60.2744
Bond Count [?]
All:24
Single:19
Double:5
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:320.384
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.58
LogP (Chemaxon):1.86

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue