CAS RN: 93675-96-8

Campsiketalin

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250203 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS93675-96-8
  • Purity/Analytical Methods: >99.0%
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93675-96-8 / 1-(2-hydroxyethyl)-4,4-dimethoxycyclohexan-1-ol

Standard CAS: 93675-96-8 Multi CAS: No

Basic Information

CAS
93675-96-8
Multi CAS
No
Molecular Formula
C10H20O4
Molecular Weight
204.260000
Exact Mass
204.136159
InChI
InChI=1S/C10H20O4/c1-13-10(14-2)5-3-9(12,4-6-10)7-8-11/h11-12H,3-8H2,1-2H3
InChIKey
DOKCJLOUSAOWIY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
51.87
TPSA
58.92

LogP / Solubility

WLOGP
0.66
MLOGP
0.58
XLogP3
0.5
Consensus LogP
0.58
Log S (ESOL)
-1.26
Class (ESOL)
Soluble
Log S (Ali)
-1.71
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
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)
-3.5

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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