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First Eluded Isomer
FEATURES
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NAMES
  • FIRST ELUDED ISOMER
SMILES
C[C@@H](O[C@H]1CN2C(=O)C3CN(C4=CC(=O)CC4)CC3[C@H]2[C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChI
InChI=1S/C30H27F7N2O3/c1-15(17-8-18(29(32,33)34)10-19(9-17)30(35,36)37)42-25-14-39-27(26(25)16-2-4-20(31)5-3-16)23-12-38(13-24(23)28(39)41)21-6-7-22(40)11-21/h2-5,8-11,15,23-27H,6-7,12-14H2,1H3/t15-,23?,24?,25+,26-,27+/m1/s1
MOLECULAR FORMULA
C30H27F7N2O3
CROSS REFERENCES
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First Eluded Isomer

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 596.19
AlogP 6.11
HBond donors 0
HBond acceptors 5
Atoms 69
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 First Eluded Isomer.