BiSSCat
Substructure Search
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FGROUP
SUBSTRUCTURE
compound
enzyme
Multiple
Elements
Database
compound
fgroup
substructure
atom
bond
conj
frag
ring
skel
vici
Properties
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ORBITAL
- sp
- sp2
- sp3
RING
- 3-membered ring
- 4-membered ring
- 5-membered ring
- 6-membered ring
AROMATIC RING
- 5-membered aromatic ring
- 6-membered aromatic ring
TOPOLOGY
- Attached to 0 non-hydrogen atom
- Attached to 1 non-hydrogen atom
- Attached to 2 non-hydrogen atoms
- Attached to 3 non-hydrogen atoms
- Attached to 4 non-hydrogen atoms
ELECTROCHEMICAL PROPERTIES
- Cation
- Anion
- Donor of hydrogen bond
- Acceptor of hydrogen bond
- Polar
- Hydrophobic
- None
OTHER PROPERTIES
- Nitrogen of amide
- Carbon of carboxylate
- Conjugated double bonds
- Resonance
Aromatic ring
Not included.
5-membered aromatic ring
Not included.
6-membered aromatic ring
Not included.
conjugated double bond
Not included.
carboxylate
Not included.
Positive charge
Not included.
Negative charge
Not included.
Donor atom
Not included.
Acceptor atom
Not included.
Polar atom
Not included.
Hydrophobic atom
4
Undefined atom
Not included.
hand
2
amide
Not included.
Ring
Not included.
3-membered ring
Not included.
4-membered ring
Not included.
5-membered ring
Not included.
6-membered ring
Not included.
resonance
1
sp1 atom
Not included.
sp2 atom
Not included.
sp3 atom
4
x0
Not included.
x1
Not included.
x2
4
x3
Not included.
x4
Not included.
BiSSCat v1.06.20
http://bisscat.org/
Developed by Masaaki Kotera, Department of Biochemistry, Trinity College Dublin.
Science Foundation of Ireland is gratefully acknowledged.