CAS RN: 745-62-0

PROSTAGLANDIN F1ALPHA

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260622 1mg / 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS745-62-0
  • Purity/Analytical Methods: >99.0%
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745-62-0 / 7-[3,5-dihydroxy-2-(3-hydroxyoct-1-enyl)cyclopentyl]heptanoic acid

Standard CAS: 745-62-0 Multi CAS: Yes

Basic Information

CAS
745-62-0
Multi CAS
Yes
Molecular Formula
C20H36O5
Molecular Weight
356.500000
Exact Mass
356.256274
InChI
InChI=1S/C20H36O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-19,21-23H,2-11,14H2,1H3,(H,24,25)
InChIKey
DZUXGQBLFALXCR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
0.85
Rotatable bonds
13
H-bond acceptors
4
H-bond donors
4
Molar refractivity
98.24
TPSA
97.99

LogP / Solubility

WLOGP
3.27
MLOGP
2.89
XLogP3
3.5
Consensus LogP
3.22
Log S (ESOL)
-3.25
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.25
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.58

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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