Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| July 23rd, 2004 |
23 |
Yes
|
Other Names:
4-(o-Chlorophenyl)-2-ethyl-9-methyl-6H-thieno(3,2-f)-s-triazolo(4,3-a)(1,4)diazepine; 4H-s-Triazolo(3,4-c)thieno(2,3-e)(1,4)-diazepine, 6-(o-chlorophenyl)-8-ethyl-1-methyl-; 6-(o-Chlorophenyl)-8-ethyl-1-methyl-4H-s-triazolo(3,4-c)thieno(2,3-e)(1,4)-diazep
40054-69-1; D01514; Etizolam (JP16/INN); Sedekopan (TN)
Depas
Etizolam (INN
Etizolam (JAN
INN)
JAN
MFCD00867532
MI
MI)
N/A
Pasaden
Y-7131
Download:
MOL2
SDF
SMILES
Flexibase
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)
|
3.03 |
9.77 |
-12.84 |
0 |
4 |
0 |
43 |
342.855 |
2 |
↓
|
|
Mid
Mid (pH 6-8)
|
3.03 |
10.72 |
-32.69 |
1 |
4 |
1 |
45 |
343.863 |
2 |
↓
|
Vendor Notes
No pre-computed analogs available. Try a structural similarity search.
