|
Analogs
-
57994208
-
-
3415748
-
-
36828407
-
-
23040527
-
-
23040528
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone
[(4aR,8aS)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.26 |
11.16 |
-11.84 |
0 |
3 |
0 |
33 |
352.503 |
3 |
↓
|
|
|
Analogs
-
57994208
-
-
3415748
-
-
36828407
-
-
23040527
-
-
23040528
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone
[(4aS,8aS)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.26 |
11.06 |
-10.65 |
0 |
3 |
0 |
33 |
352.503 |
3 |
↓
|
|
|
Analogs
-
57994208
-
-
3415748
-
-
36828407
-
-
23040527
-
-
23040528
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.26 |
11.13 |
-12.85 |
0 |
3 |
0 |
33 |
352.503 |
3 |
↓
|
|
|
Analogs
-
57994208
-
-
3415748
-
-
36828407
-
-
23040527
-
-
23040528
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.26 |
11.13 |
-12.13 |
0 |
3 |
0 |
33 |
352.503 |
3 |
↓
|
|
|
Analogs
-
3415748
-
-
6607298
-
-
36828407
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-[2-(p-tolylsulfanyl)-3-pyridyl]methanone
[(4aR,8aS)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.71 |
11.83 |
-11.81 |
0 |
3 |
0 |
33 |
366.53 |
3 |
↓
|
|
|
Analogs
-
3415748
-
-
6607298
-
-
36828407
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-[2-(p-tolylsulfanyl)-3-pyridyl]methanone
[(4aS,8aS)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.71 |
11.73 |
-10.55 |
0 |
3 |
0 |
33 |
366.53 |
3 |
↓
|
|
|
Analogs
-
3415748
-
-
6607298
-
-
36828407
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-[2-(p-tolylsulfanyl)-3-pyridyl]methanone
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.71 |
11.8 |
-12.75 |
0 |
3 |
0 |
33 |
366.53 |
3 |
↓
|
|
|
Analogs
-
3415748
-
-
6607298
-
-
36828407
-
Draw
Identity
99%
90%
80%
70%
Popular Name:
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-[2-(p-tolylsulfanyl)-3-pyridyl]methanone
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-oct…
Find On:
PubMed —
Wikipedia —
Google
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
4.71 |
11.81 |
-12.06 |
0 |
3 |
0 |
33 |
366.53 |
3 |
↓
|
|