can
SAR
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canSAR2080215
FEATURES
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NAMES
SMILES
O=C(O)c1cc(S(=O)(=O)NCC2CCCCC2)c2ccccc2c1O
InChI
InChI=1S/C18H21NO5S/c20-17-14-9-5-4-8-13(14)16(10-15(17)18(21)22)25(23,24)19-11-12-6-2-1-3-7-12/h4-5,8-10,12,19-20H,1-3,6-7,11H2,(H,21,22)
MOLECULAR FORMULA
C18H21NO5S
CROSS REFERENCES
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canSAR2080215
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Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight
363.11
AlogP
3.10
HBond donors
3
HBond acceptors
6
Atoms
46
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 canSAR2080215.