SB-T-12842-4
FEATURES
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NAMES
  • SB-T-12842-4
SMILES
CCC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2cccc(N=[N+]=[N-])c2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(F)F)C(C)=C1C2(C)C
InChI
InChI=1S/C41H52F2N4O15/c1-10-25(50)59-29-26-18(2)22(58-35(54)28(51)27(33(42)43)45-36(55)62-37(4,5)6)16-41(56,38(26,7)8)32(60-34(53)20-12-11-13-21(14-20)46-47-44)30-39(9,31(29)52)23(49)15-24-40(30,17-57-24)61-19(3)48/h11-14,22-24,27-30,32-33,49,51,56H,10,15-17H2,1-9H3,(H,45,55)/t22-,23-,24+,27+,28+,29+,30-,32-,39+,40-,41+/m0/s1
MOLECULAR FORMULA
C41H52F2N4O15
CROSS REFERENCES
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SB-T-12842-4
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight878.34
AlogP4.05
HBond donors4
HBond acceptors19
Atoms114
Contains toxicophoreYes
Contains PAINSYes
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by SB-T-12842-4.