can
SAR
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canSAR209596
FEATURES
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NAMES
SMILES
CN(C)c1ccc(C(=O)N[C@@H](CCCCCC(=O)NO)C(=O)NC2(Cc3ccccc3)CCCC2)cc1
InChI
InChI=1S/C29H40N4O4/c1-33(2)24-17-15-23(16-18-24)27(35)30-25(13-7-4-8-14-26(34)32-37)28(36)31-29(19-9-10-20-29)21-22-11-5-3-6-12-22/h3,5-6,11-12,15-18,25,37H,4,7-10,13-14,19-21H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)/t25-/m0/s1
MOLECULAR FORMULA
C29H40N4O4
CROSS REFERENCES
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canSAR209596
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Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight
508.30
AlogP
3.98
HBond donors
4
HBond acceptors
8
Atoms
77
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 canSAR209596.