CAS RN: 78056-28-7
AKOS BC-0240
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250927 | 1g | Out of stock | Inquiry |
- Product code: starshine_CAS78056-28-7
- Purity/Analytical Methods: >99.0%
78056-28-7 / 3-methyladamantan-1-amine
Basic Information
CAS
78056-28-7
Multi CAS
Yes
Molecular Formula
C11H19N
Molecular Weight
165.270000
Exact Mass
165.151750
InChI
InChI=1S/C11H19N/c1-10-3-8-2-9(4-10)6-11(12,5-8)7-10/h8-9H,2-7,12H2,1H3
InChIKey
MWMFMCTUGUZSJJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
49.71
TPSA
26.02
LogP / Solubility
WLOGP
2.3
MLOGP
2.02
XLogP3
3
Consensus LogP
2.44
Log S (ESOL)
-2.32
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.65
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
7
