Sapphyrin
FEATURES
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NAMES
  • Sapphyrin
SMILES
CCc1c(CC)c2cc3nc(cc4[nH]c(c(C)c4CC)c4[nH]c(cc5nc(cc1[nH]2)C(CCC(=O)N(CCO)CCO)=C5C)c(CC)c4C)C(C)=C3CCC(=O)N(CCO)CCO
InChI
InChI=1S/C50H67N7O6/c1-9-33-31(7)49-50-32(8)34(10-2)42(55-50)26-40-30(6)38(14-16-48(63)57(19-23-60)20-24-61)46(52-40)28-44-36(12-4)35(11-3)43(53-44)27-45-37(29(5)39(51-45)25-41(33)54-49)13-15-47(62)56(17-21-58)18-22-59/h25-28,53-55,58-61H,9-24H2,1-8H3/b39-25-,40-26-,41-25-,42-26-,43-27-,44-28-,45-27-,46-28-,50-49-
MOLECULAR FORMULA
C50H67N7O6
CROSS REFERENCES
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Sapphyrin
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight861.52
AlogP7.27
HBond donors7
HBond acceptors13
Atoms130
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Sapphyrin.