749762 logo
HDD
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
  • HDD
SMILES
C=Cc1c(C)c2n3c1C=C1N4C(=Cc5c(CCC(=O)O)c(C)c6n5[Fe]43n3c(c(C)c(C=C)c3=C2)=C6)[C@]2(CCC(=O)O2)[C@@]1(C)O
InChI
InChI=1S/C34H32N4O5.Fe/c1-7-20-17(3)23-13-24-19(5)22(9-10-31(39)40)28(37-24)16-30-34(12-11-32(41)43-34)33(6,42)29(38-30)15-27-21(8-2)18(4)25(36-27)14-26(20)35-23;/h7-8,13-16,42H,1-2,9-12H2,3-6H3,(H,39,40);/q-4;+4/b23-13-,26-14-,29-15-,30-16-;/t33-,34+;/m0./s1
MOLECULAR FORMULA
C34H32FeN4O5
CROSS REFERENCES
749762 logo

HDD

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 632.17
AlogP 3.21
HBond donors 2
HBond acceptors 9
Atoms 76
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by HDD.