[email protected]
CAS 70023-02-8 GLY-ASP-ASP-ASP-ASP-LYS BETA-NAPHTHYLAMIDE molecular structure lightbox
CAS RN: 70023-02-8

GLY-ASP-ASP-ASP-ASP-LYS BETA-NAPHTHYLAMIDE

Product Availability

Choose a grade to view its available package options.

2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250212 10mg / 50mg / 250mg Confirm by inquiry Shanghai, Shandong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251115 10mg In stock Shanghai Inquiry
  • Product code: starshine_CAS70023-02-8
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

70023-02-8 / (3S)-3-[(2-aminoacetyl)amino]-4-[[(2S)-1-[[(2S)-1-[[1-[[(2S)-6-amino-1-(naphthalen-2-ylamino)-1-oxohexan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid

Standard CAS: 70023-02-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
70023-02-8
Multi CAS
Yes
Molecular Formula
C34H44N8O14
Molecular Weight
788.800000
Exact Mass
788.297698
InChI
InChI=1S/C34H44N8O14/c35-10-4-3-7-20(30(52)37-19-9-8-17-5-1-2-6-18(17)11-19)39-32(54)22(13-27(46)47)41-34(56)24(15-29(50)51)42-33(55)23(14-28(48)49)40-31(53)21(12-26(44)45)38-25(43)16-36/h1-2,5-6,8-9,11,20-24H,3-4,7,10,12-16,35-36H2,(H,37,52)(H,38,43)(H,39,54)(H,40,53)(H,41,56)(H,42,55)(H,44,45)(H,46,47)(H,48,49)(H,50,51)/t20-,21-,22?,23-,24-/m0/s1
InChIKey
QLLWULMEPVZWTP-VPRBCIFISA-N

Computed Properties

Structural Parameters

Heavy atom count
56
Aromatic heavy atom count
10
Fraction Csp3
0.41
Rotatable bonds
24
H-bond acceptors
12
H-bond donors
12
Molar refractivity
193.2
TPSA
375.84

LogP / Solubility

WLOGP
-2.81
MLOGP
-2.4
XLogP3
-8.1
Consensus LogP
-4.44
Log S (ESOL)
-1.51
Class (ESOL)
Soluble
Log S (Ali)
-4
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.33
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-9.53

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5

Customers Also Viewed

Get In Touch

Contact Us