Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| January 20th, 2014 |
0 |
No
|
Popular Name:
4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
4-(dimethylamino)-3,6,10,12,12a-…
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Other Names:
4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-naphthacenecarboxamide methanesulfonate; nsc69343
Hexadecylsulfamic acid compd. with (4S-(4alpha,4aalpha,5aalpha,6beta,12aalpha))-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1); LS-147682; N-(n-Hexadecyl)sulfamate de tetracyc
MFCD00066847
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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 |
|
Mid
Mid (pH 6-8)
|
-0.69 |
-1 |
-56.31 |
7 |
10 |
0 |
186 |
444.44 |
2 |
↓
|
No pre-computed analogs available. Try a structural similarity search.
