Chemical ID: 4368514

COc1ccc(cc1)NCC(CN2c3ccccc3Sc4c2cccc4)O
Chemical ID:
4368514
Name [?]:
1-(4-methoxyphenyl)amino-3-phenothiazin-10-yl-propan-2-ol
SMILES [?]:
COc1ccc(cc1)NCC(CN2c3ccccc3Sc4c2cccc4)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H22N2O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:9.83643
Area:591.168
Solvation:-4.94278
Coulombic:-44.0615
Bond Count [?]
All:30
Single:21
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:378.488
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.79
LogP (Chemaxon):4.82

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