Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| October 12th, 2004 |
36 |
No
|
Popular Name:
9-[3-chloro-5-methoxy-4-(2-propynyloxy)phenyl]-3,3,6,6-tetramethyl-10-propyl-3,4,6,7,9,10-hexahydro-1,8(2H,5H)-acridinedione
9-[3-chloro-5-methoxy-4-(2-propy…
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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 |
|
Ref
Reference (pH 7)
|
6.35 |
5.23 |
-23.9 |
0 |
5 |
0 |
55 |
510.074 |
6 |
↓
|
Rings
-
1,4-dihydropyridine
-
Benzene
-
Cyclohex-2-en-1-one
-
2,3,4,5,6,7,9,10-octahydroacridi…
-
9-phenyl-2,3,4,5,6,7,9,10-octahy…
No pre-computed analogs available. Try a structural similarity search.
