CAS RN: 63939-65-1
OXOTREMORINE M
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260612 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS63939-65-1
- Purity/Analytical Methods: >99.0%
63939-65-1 / trimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]azanium
Basic Information
CAS
63939-65-1
Multi CAS
Yes
Molecular Formula
C11H19N2O
Molecular Weight
195.280000
Exact Mass
195.149738
InChI
InChI=1S/C11H19N2O/c1-13(2,3)10-5-4-8-12-9-6-7-11(12)14/h6-10H2,1-3H3/q+1
InChIKey
CANZROMYQDHYHR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.73
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
56.49
TPSA
20.31
LogP / Solubility
WLOGP
0.32
MLOGP
0.28
XLogP3
-0.1
Consensus LogP
0.17
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-1.39
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.43
Class (SILICOS-IT)
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)
-3.69
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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