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CAS 78709-81-6 2-FLUORO-L-TYROSINE molecular structure lightbox
CAS RN: 78709-81-6

2-FLUORO-L-TYROSINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251224 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS78709-81-6
  • Purity/Analytical Methods: >99.0%
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78709-81-6 / (2S)-2-amino-3-(2-fluoro-4-hydroxyphenyl)propanoic acid

Standard CAS: 78709-81-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
78709-81-6
Multi CAS
Yes
Molecular Formula
C9FH10NO3
Molecular Weight
199.180000
Exact Mass
199.064471
InChI
InChI=1S/C9H10FNO3/c10-7-4-6(12)2-1-5(7)3-8(11)9(13)14/h1-2,4,8,12H,3,11H2,(H,13,14)/t8-/m0/s1
InChIKey
WEJIXBMNLWITCR-QMMMGPOBSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
3
Molar refractivity
47.38
TPSA
83.55

LogP / Solubility

WLOGP
0.49
MLOGP
0.43
XLogP3
-1.7
Consensus LogP
-0.26
Log S (ESOL)
-1.5
Class (ESOL)
Soluble
Log S (Ali)
-1.54
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.72
Class (SILICOS-IT)
Soluble

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
No
Log Kp (skin permeation)
-3.59

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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