B3G
FEATURES
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NAMES
  • B3G
SMILES
CC(C)CC(NC(=O)OCCc1cccc(Cl)c1)C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O
InChI
InChI=1S/C22H32ClN3O8S/c1-13(2)10-17(26-22(30)34-9-7-14-4-3-5-16(23)11-14)20(28)25-18(21(29)35(31,32)33)12-15-6-8-24-19(15)27/h3-5,11,13,15,17-18,21,29H,6-10,12H2,1-2H3,(H,24,27)(H,25,28)(H,26,30)(H,31,32,33)/t15-,17-,18-,21+/m0/s1
MOLECULAR FORMULA
C22H32ClN3O8S
CROSS REFERENCES
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B3G
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight533.16
AlogP1.24
HBond donors5
HBond acceptors11
Atoms67
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by B3G.