TCMDC-137978
FEATURES
Loading...
NAMES
  • TCMDC-137978
SMILES
Cc1nc2ccc(S(=O)(=O)Nc3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)cc2c(=O)[nH]1
InChI
InChI=1S/C21H20N4O8S/c1-11-22-16-7-6-14(10-15(16)20(29)23-11)34(32,33)25-13-4-2-12(3-5-13)19(28)24-17(21(30)31)8-9-18(26)27/h2-7,10,17,25H,8-9H2,1H3,(H,24,28)(H,26,27)(H,30,31)(H,22,23,29)/t17-/m0/s1
MOLECULAR FORMULA
C21H20N4O8S
CROSS REFERENCES
Loading...
TCMDC-137978
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight488.10
AlogP1.08
HBond donors5
HBond acceptors12
Atoms54
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-137978.