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XMM
FEATURES
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NAMES
  • XMM
SMILES
OC[C@H]1O[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@@H](O)[C@@H](O)[C@@H]1O
InChI
InChI=1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13+,14+/m1/s1
MOLECULAR FORMULA
C14H15BrClNO6
CROSS REFERENCES
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XMM

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 406.98
AlogP 0.76
HBond donors 5
HBond acceptors 7
Atoms 38
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by XMM.