[email protected]
CAS 79994-24-4 H-TYR-GLY-GLY-PHE-LEU-ARG-ARG-ILE-ARG-PRO-OH molecular structure lightbox
CAS RN: 79994-24-4

H-TYR-GLY-GLY-PHE-LEU-ARG-ARG-ILE-ARG-PRO-OH

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260606 1mg / 5mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS79994-24-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

79994-24-4 / (2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carboxylic acid

Standard CAS: 79994-24-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
79994-24-4
Multi CAS
Yes
Molecular Formula
C57H91N19O12
Molecular Weight
1234.500000
Exact Mass
1233.709459
InChI
InChI=1S/C57H91N19O12/c1-5-33(4)46(52(85)73-40(17-11-25-67-57(63)64)53(86)76-26-12-18-43(76)54(87)88)75-49(82)39(16-10-24-66-56(61)62)71-48(81)38(15-9-23-65-55(59)60)72-50(83)41(27-32(2)3)74-51(84)42(29-34-13-7-6-8-14-34)70-45(79)31-68-44(78)30-69-47(80)37(58)28-35-19-21-36(77)22-20-35/h6-8,13-14,19-22,32-33,37-43,46,77H,5,9-12,15-18,23-31,58H2,1-4H3,(H,68,78)(H,69,80)(H,70,79)(H,71,81)(H,72,83)(H,73,85)(H,74,84)(H,75,82)(H,87,88)(H4,59,60,65)(H4,61,62,66)(H4,63,64,67)
InChIKey
XPAZYWMYTUESNI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
88
Aromatic heavy atom count
12
Fraction Csp3
0.56
Rotatable bonds
38
H-bond acceptors
15
H-bond donors
17
Molar refractivity
328.55
TPSA
529.86

LogP / Solubility

WLOGP
-4.03
MLOGP
-3.42
XLogP3
-3.9
Consensus LogP
-3.78
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-6.78
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.9
Class (SILICOS-IT)
Insoluble

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)
-13.11

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
8.5

Customers Also Viewed

Get In Touch

Contact Us