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CAS 34078-85-8 Z-GLN-OSU molecular structure lightbox
CAS RN: 34078-85-8

Z-GLN-OSU

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Batchno.20250831 5g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS34078-85-8
  • Purity/Analytical Methods: >99.0%
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34078-85-8 / (2,5-dioxopyrrolidin-1-yl) 5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoate

Standard CAS: 34078-85-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
34078-85-8
Multi CAS
Yes
Molecular Formula
C17H19N3O7
Molecular Weight
377.300000
Exact Mass
377.122300
InChI
InChI=1S/C17H19N3O7/c18-13(21)7-6-12(16(24)27-20-14(22)8-9-15(20)23)19-17(25)26-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H2,18,21)(H,19,25)/t12-/m0/s1
InChIKey
KAADPWIOJORBEB-LBPRGKRZSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
6
Fraction Csp3
0.35
Rotatable bonds
8
H-bond acceptors
7
H-bond donors
2
Molar refractivity
89.16
TPSA
145.1

LogP / Solubility

WLOGP
0.15
MLOGP
0.16
XLogP3
-0.3
Consensus LogP
0.0000
Log S (ESOL)
-1.91
Class (ESOL)
Soluble
Log S (Ali)
-2.77
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.2
Class (SILICOS-IT)
Poorly 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)
-4.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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