CAS RN: 300801-03-0

[glycyl-κN-L-histidyl-κN,κN3-L-lysinato(2-)]-Copper, monoacetate (9CI)

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250225 100mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250403 100mg In stock Shanghai Inquiry
Batchno.20250127 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250825 250mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20260701 250mg Out of stock 8-10 business days Inquiry
Batchno.20250405 5g In stock Shenzhen, Tianjin, Wuhan Inquiry
  • Product code: starshine_CAS300801-03-0
  • Purity/Analytical Methods: >99.0%
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300801-03-0 / copper;acetic acid;(2S)-6-amino-2-[[(2S)-2-(2-azanidylacetyl)azanidyl-3-(1H-imidazol-4-yl)propanoyl]amino]hexanoate

Standard CAS: 300801-03-0 Multi CAS: Yes

Basic Information

CAS
300801-03-0
Multi CAS
Yes
Molecular Formula
C17H25N6O6U
Molecular Weight
460.950000
Exact Mass
460.113155
InChI
InChI=1S/2C14H24N6O4.Cu/c2*15-4-2-1-3-10(14(23)24)20-13(22)11(19-12(21)6-16)5-9-7-17-8-18-9;/h2*7-8,10-11H,1-6,15-16H2,(H,17,18)(H,19,21)(H,20,22)(H,23,24);/q;;+2/p-2/t2*10-,11-;/m00./s1
InChIKey
YINACRBQQGZRRM-XTQNZXNBSA-L

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
5
Fraction Csp3
0.56
Rotatable bonds
11
H-bond acceptors
7
H-bond donors
4
Molar refractivity
96.79
TPSA
216.2

LogP / Solubility

WLOGP
-1.27
MLOGP
-1.09
XLogP3
-1.27
Consensus LogP
-1.21
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.92
Class (SILICOS-IT)
Moderately 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)
-6.44

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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