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CAS 14656-09-8 H-GLY-PHE-GLY-OH molecular structure lightbox
CAS RN: 14656-09-8

H-GLY-PHE-GLY-OH

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260104 10mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS14656-09-8
  • Purity/Analytical Methods: >99.0%
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14656-09-8 / 2-[[(2S)-2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]acetic acid

Standard CAS: 14656-09-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14656-09-8
Multi CAS
No
Molecular Formula
C13H17N3O4
Molecular Weight
279.290000
Exact Mass
279.121906
SMILES
C1=CC=C(C=C1)C[C@@H](C(=O)NCC(=O)O)NC(=O)CN
InChI
InChI=1S/C13H17N3O4/c14-7-11(17)16-10(13(20)15-8-12(18)19)6-9-4-2-1-3-5-9/h1-5,10H,6-8,14H2,(H,15,20)(H,16,17)(H,18,19)/t10-/m0/s1
InChIKey
IGOYNRWLWHWAQO-JTQLQIEISA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
6
Fraction Csp3
0.31
Rotatable bonds
7
H-bond acceptors
4
H-bond donors
4
Molar refractivity
71.78
TPSA
121.52

LogP / Solubility

WLOGP
-1.13
MLOGP
-0.98
XLogP3
-3
Consensus LogP
-1.7
Log S (ESOL)
-0.62
Class (ESOL)
Very soluble
Log S (Ali)
-1.04
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.38
Class (SILICOS-IT)
Soluble

ADME

GI absorption
Low
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)
-5.22

Drug-likeness / Medicinal Chemistry

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

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