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NSC-65575
FEATURES
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NAMES
  • NSC-65575
SMILES
Cc1ccc(/N=N/c2c(S(=O)(=O)O)cc3cc(NC(=O)Nc4ccc5c(O)c(/N=N/c6ccc7cc(S(=O)(=O)O)ccc7c6)c(S(=O)(=O)O)cc5c4)ccc3c2O)c(C)c1
InChI
InChI=1S/C39H30N6O12S3/c1-20-3-12-32(21(2)13-20)43-45-36-34(60(55,56)57)19-25-16-27(8-11-31(25)38(36)47)41-39(48)40-26-7-10-30-24(15-26)18-33(59(52,53)54)35(37(30)46)44-42-28-6-4-23-17-29(58(49,50)51)9-5-22(23)14-28/h3-19,46-47H,1-2H3,(H2,40,41,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)/b44-42+,45-43+
MOLECULAR FORMULA
C39H30N6O12S3
CROSS REFERENCES
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NSC-65575

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 870.11
AlogP 9.39
HBond donors 7
HBond acceptors 18
Atoms 90
Contains toxicophore Yes
Contains PAINS Yes
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by NSC-65575.