|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-amine
(11R)-6-chloro-2,3,7,8,10,11-hex…
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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)
|
-0.31 |
2.15 |
-41.83 |
3 |
4 |
1 |
55 |
256.709 |
0 |
↓
|
Mid
Mid (pH 6-8)
|
-0.31 |
1.98 |
-4.86 |
2 |
4 |
0 |
54 |
255.701 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-amine
(11S)-6-chloro-2,3,7,8,10,11-hex…
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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)
|
-0.31 |
2.15 |
-42.25 |
3 |
4 |
1 |
55 |
256.709 |
0 |
↓
|
Mid
Mid (pH 6-8)
|
-0.31 |
2.36 |
-4.96 |
2 |
4 |
0 |
54 |
255.701 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-chloro-N-methyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11S)-6-chloro-N-methyl-2,3,7,8,…
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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)
|
1.94 |
3.87 |
-36.56 |
2 |
4 |
1 |
44 |
270.736 |
1 |
↓
|
Mid
Mid (pH 6-8)
|
1.94 |
3.07 |
-4.52 |
1 |
4 |
0 |
40 |
269.728 |
1 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-chloro-N-methyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11R)-6-chloro-N-methyl-2,3,7,8,…
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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)
|
1.94 |
3.86 |
-36.32 |
2 |
4 |
1 |
44 |
270.736 |
1 |
↓
|
Mid
Mid (pH 6-8)
|
1.94 |
2.99 |
-4.8 |
1 |
4 |
0 |
40 |
269.728 |
1 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-chloro-N-ethyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11S)-6-chloro-N-ethyl-2,3,7,8,1…
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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)
|
2.32 |
4.69 |
-34.94 |
2 |
4 |
1 |
44 |
284.763 |
2 |
↓
|
Hi
High (pH 8-9.5)
|
2.32 |
3.97 |
-4.29 |
1 |
4 |
0 |
40 |
283.755 |
2 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-chloro-N-ethyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11R)-6-chloro-N-ethyl-2,3,7,8,1…
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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)
|
2.32 |
4.7 |
-34.74 |
2 |
4 |
1 |
44 |
284.763 |
2 |
↓
|
Hi
High (pH 8-9.5)
|
2.32 |
3.91 |
-4.6 |
1 |
4 |
0 |
40 |
283.755 |
2 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-chloro-N-propyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11S)-6-chloro-N-propyl-2,3,7,8,…
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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)
|
2.82 |
5.45 |
-35.38 |
2 |
4 |
1 |
44 |
298.79 |
3 |
↓
|
Hi
High (pH 8-9.5)
|
2.82 |
4.74 |
-4.19 |
1 |
4 |
0 |
40 |
297.782 |
3 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-chloro-N-propyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11R)-6-chloro-N-propyl-2,3,7,8,…
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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)
|
2.82 |
5.46 |
-35.14 |
2 |
4 |
1 |
44 |
298.79 |
3 |
↓
|
Hi
High (pH 8-9.5)
|
2.82 |
4.67 |
-4.47 |
1 |
4 |
0 |
40 |
297.782 |
3 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-bromo-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-amine
(11R)-6-bromo-2,3,7,8,10,11-hexa…
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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)
|
-0.18 |
2.25 |
-41.83 |
3 |
4 |
1 |
55 |
301.16 |
0 |
↓
|
Mid
Mid (pH 6-8)
|
-0.18 |
2.05 |
-4.91 |
2 |
4 |
0 |
54 |
300.152 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-bromo-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-amine
(11S)-6-bromo-2,3,7,8,10,11-hexa…
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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)
|
-0.18 |
2.24 |
-42.27 |
3 |
4 |
1 |
55 |
301.16 |
0 |
↓
|
Mid
Mid (pH 6-8)
|
-0.18 |
2.46 |
-4.99 |
2 |
4 |
0 |
54 |
300.152 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-bromo-N-methyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11S)-6-bromo-N-methyl-2,3,7,8,1…
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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)
|
2.08 |
3.95 |
-36.63 |
2 |
4 |
1 |
44 |
315.187 |
1 |
↓
|
Mid
Mid (pH 6-8)
|
2.08 |
3.15 |
-4.49 |
1 |
4 |
0 |
40 |
314.179 |
1 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-bromo-N-methyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11R)-6-bromo-N-methyl-2,3,7,8,1…
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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)
|
2.08 |
3.98 |
-36.28 |
2 |
4 |
1 |
44 |
315.187 |
1 |
↓
|
Mid
Mid (pH 6-8)
|
2.08 |
3.09 |
-4.76 |
1 |
4 |
0 |
40 |
314.179 |
1 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-bromo-N-ethyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11S)-6-bromo-N-ethyl-2,3,7,8,10…
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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)
|
2.45 |
4.79 |
-34.97 |
2 |
4 |
1 |
44 |
329.214 |
2 |
↓
|
Hi
High (pH 8-9.5)
|
2.45 |
4.05 |
-4.3 |
1 |
4 |
0 |
40 |
328.206 |
2 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-bromo-N-ethyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11R)-6-bromo-N-ethyl-2,3,7,8,10…
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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)
|
2.45 |
4.82 |
-34.69 |
2 |
4 |
1 |
44 |
329.214 |
2 |
↓
|
Hi
High (pH 8-9.5)
|
2.45 |
3.99 |
-4.56 |
1 |
4 |
0 |
40 |
328.206 |
2 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-bromo-N-propyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11S)-6-bromo-N-propyl-2,3,7,8,1…
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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)
|
2.95 |
5.55 |
-35.44 |
2 |
4 |
1 |
44 |
343.241 |
3 |
↓
|
Hi
High (pH 8-9.5)
|
2.95 |
4.81 |
-4.16 |
1 |
4 |
0 |
40 |
342.233 |
3 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-bromo-N-propyl-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-g][3]benzoxepin-11-amine
(11R)-6-bromo-N-propyl-2,3,7,8,1…
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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)
|
2.95 |
5.59 |
-35.14 |
2 |
4 |
1 |
44 |
343.241 |
3 |
↓
|
Hi
High (pH 8-9.5)
|
2.95 |
4.75 |
-4.48 |
1 |
4 |
0 |
40 |
342.233 |
3 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-ol
(11R)-6-chloro-2,3,7,8,10,11-hex…
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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)
|
1.39 |
2.34 |
-6.6 |
1 |
4 |
0 |
48 |
256.685 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-ol
(11S)-6-chloro-2,3,7,8,10,11-hex…
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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)
|
1.39 |
2.71 |
-6.63 |
1 |
4 |
0 |
48 |
256.685 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-bromo-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-ol
(11R)-6-bromo-2,3,7,8,10,11-hexa…
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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)
|
1.52 |
2.45 |
-6.54 |
1 |
4 |
0 |
48 |
301.136 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-bromo-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepin-11-ol
(11S)-6-bromo-2,3,7,8,10,11-hexa…
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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)
|
1.52 |
2.8 |
-6.67 |
1 |
4 |
0 |
48 |
301.136 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6,11-dichloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11R)-6,11-dichloro-2,3,7,8,10,1…
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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)
|
2.77 |
5.22 |
-5.05 |
0 |
3 |
0 |
28 |
275.131 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6,11-dichloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11S)-6,11-dichloro-2,3,7,8,10,1…
Find On:
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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)
|
2.77 |
5.38 |
-4.21 |
0 |
3 |
0 |
28 |
275.131 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-11-bromo-6-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11R)-11-bromo-6-chloro-2,3,7,8,…
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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)
|
2.90 |
5.32 |
-4.82 |
0 |
3 |
0 |
28 |
319.582 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-11-bromo-6-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11S)-11-bromo-6-chloro-2,3,7,8,…
Find On:
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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)
|
2.90 |
5.52 |
-3.84 |
0 |
3 |
0 |
28 |
319.582 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6-bromo-11-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11R)-6-bromo-11-chloro-2,3,7,8,…
Find On:
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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)
|
2.90 |
5.32 |
-5.03 |
0 |
3 |
0 |
28 |
319.582 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6-bromo-11-chloro-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11S)-6-bromo-11-chloro-2,3,7,8,…
Find On:
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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)
|
2.90 |
5.46 |
-4.2 |
0 |
3 |
0 |
28 |
319.582 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11R)-6,11-dibromo-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11R)-6,11-dibromo-2,3,7,8,10,11…
Find On:
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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)
|
3.03 |
5.4 |
-4.8 |
0 |
3 |
0 |
28 |
364.033 |
0 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Popular Name:
(11S)-6,11-dibromo-2,3,7,8,10,11-hexahydro-[1,4]dioxino[2,3-i][3]benzoxepine
(11S)-6,11-dibromo-2,3,7,8,10,11…
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)
|
3.03 |
5.61 |
-3.86 |
0 |
3 |
0 |
28 |
364.033 |
0 |
↓
|
|