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TCMDC-138112
FEATURES
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NAMES
  • TCMDC-138112
SMILES
Cc1nc(O)c2c(ccc3ccc(CNc4ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)c(F)c4)cc32)n1
InChI
InChI=1S/C26H23FN4O6/c1-13-29-20-7-4-15-3-2-14(10-18(15)23(20)25(35)30-13)12-28-16-5-6-17(19(27)11-16)24(34)31-21(26(36)37)8-9-22(32)33/h2-7,10-11,21,28H,8-9,12H2,1H3,(H,31,34)(H,32,33)(H,36,37)(H,29,30,35)/t21-/m0/s1
MOLECULAR FORMULA
C26H23FN4O6
CROSS REFERENCES
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TCMDC-138112

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 506.16
AlogP 3.60
HBond donors 5
HBond acceptors 10
Atoms 60
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-138112.