Chemical ID: 6692451

CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)Oc2c[nH]c3c2c(c(cc3)Br)Cl)O
Chemical ID:
6692451
Name [?]:
5-acetamido-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid
SMILES [?]:
CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)Oc2c[nH]c3c2c(c(cc3)Br)Cl)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H22BrClN2O9
All Atoms:32
Heavy Atoms:32
Chiral Atoms:6
ZAP Information [?]
Total:7.2275
Area:631.453
Solvation:-8.55882
Coulombic:-144.684
Bond Count [?]
All:34
Single:28
Double:6
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:537.743
H-Bond Donors:6
H-Bond Acceptors:10
XLogP:0.59
LogP (Chemaxon):1.73

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Descriptor Annotations

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