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U-99751
FEATURES
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NAMES
  • U-99751
SMILES
CCCNC1=NC(=O)[C@@]2(CC(C)(C)Oc3ccc(Br)cc32)N1
InChI
InChI=1S/C16H20BrN3O2/c1-4-7-18-14-19-13(21)16(20-14)9-15(2,3)22-12-6-5-10(17)8-11(12)16/h5-6,8H,4,7,9H2,1-3H3,(H2,18,19,20,21)/t16-/m0/s1
MOLECULAR FORMULA
C16H20BrN3O2
CROSS REFERENCES
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U-99751

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 365.07
AlogP 2.69
HBond donors 2
HBond acceptors 5
Atoms 42
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 U-99751.