7D9
FEATURES
Loading...
NAMES
  • 7D9
SMILES
Cc1cc2c3c(c1C)C(C)(C)CC(S(=O)(=O)O)N3c1c([nH]c(=O)[nH]c1=O)N2CC(O)C(O)C(O)COP(=O)(O)O
InChI
InChI=1S/C22H31N4O12PS/c1-9-5-11-16-15(10(9)2)22(3,4)6-14(40(35,36)37)26(16)17-19(23-21(31)24-20(17)30)25(11)7-12(27)18(29)13(28)8-38-39(32,33)34/h5,12-14,18,27-29H,6-8H2,1-4H3,(H2,32,33,34)(H,35,36,37)(H2,23,24,30,31)/t12-,13+,14+,18-/m0/s1
MOLECULAR FORMULA
C22H31N4O12PS
CROSS REFERENCES
Loading...
7D9
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight606.14
AlogP-0.64
HBond donors8
HBond acceptors16
Atoms71
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 7D9.