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Escholtzine
FEATURES
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NAMES
  • Escholtzine
SMILES
CN1[C@H]2Cc3cc4c(cc3[C@@H]1Cc1cc3c(cc12)OCO3)OCO4
InChI
InChI=1S/C19H17NO4/c1-20-14-2-10-4-16-18(23-8-21-16)6-12(10)15(20)3-11-5-17-19(7-13(11)14)24-9-22-17/h4-7,14-15H,2-3,8-9H2,1H3/t14-,15-/m0/s1
MOLECULAR FORMULA
C19H17NO4
CROSS REFERENCES
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Escholtzine

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 323.12
AlogP 2.97
HBond donors 0
HBond acceptors 5
Atoms 41
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 Escholtzine.