1YA
FEATURES
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NAMES
  • 1YA
SMILES
Nc1nc2c(c(=O)[nH]1)NC(CN(C=O)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2
InChI
InChI=1S/C20H23N7O7/c21-20-25-16-15(18(32)26-20)23-11(7-22-16)8-27(9-28)12-3-1-10(2-4-12)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,11,13,23H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,22,25,26,32)/t11-,13-/m0/s1
MOLECULAR FORMULA
C20H23N7O7
CROSS REFERENCES
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1YA
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight473.17
AlogP-0.73
HBond donors8
HBond acceptors14
Atoms57
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 1YA.