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TCMDC-141415
FEATURES
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NAMES
  • TCMDC-141415
SMILES
CC[C@H]1CN2CC[C@@H]1C[C@H]2[C@H](O)c1cc(N2CCC(O)CC2)nc2ccc(OC)cc12
InChI
InChI=1S/C25H35N3O3/c1-3-16-15-28-9-6-17(16)12-23(28)25(30)21-14-24(27-10-7-18(29)8-11-27)26-22-5-4-19(31-2)13-20(21)22/h4-5,13-14,16-18,23,25,29-30H,3,6-12,15H2,1-2H3/t16-,17+,23-,25+/m0/s1
MOLECULAR FORMULA
C25H35N3O3
CROSS REFERENCES
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TCMDC-141415

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 425.27
AlogP 3.36
HBond donors 2
HBond acceptors 6
Atoms 66
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 TCMDC-141415.