CAS RN: 90377-00-7

L-a-Me-Val-NH2

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Batchno.20250217 25g / 100g / 250g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS90377-00-7
  • Purity/Analytical Methods: >99.0%
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90377-00-7 / 2-amino-2,3-dimethylbutanamide

Standard CAS: 90377-00-7 Multi CAS: Yes

Basic Information

CAS
90377-00-7
Multi CAS
Yes
Molecular Formula
C6H14N2O
Molecular Weight
130.190000
Exact Mass
130.110613
InChI
InChI=1S/C6H14N2O/c1-4(2)6(3,8)5(7)9/h4H,8H2,1-3H3,(H2,7,9)
InChIKey
YCPQUHCGFDFLSI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.83
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
36.62
TPSA
69.11

LogP / Solubility

WLOGP
-0.15
MLOGP
-0.14
XLogP3
-0.2
Consensus LogP
-0.16
Log S (ESOL)
-0.42
Class (ESOL)
Very soluble
Log S (Ali)
-0.52
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.62
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.62

Drug-likeness / Medicinal Chemistry

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

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