CAS RN: 38605-65-1

L-Proline, 1-(aminocarbonyl)- (9CI)

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Batchno.20250828 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS38605-65-1
  • Purity/Analytical Methods: >99.0%
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38605-65-1 / (2S)-1-carbamoylpyrrolidine-2-carboxylic acid

Standard CAS: 38605-65-1 Multi CAS: Yes

Basic Information

CAS
38605-65-1
Multi CAS
Yes
Molecular Formula
C6H10N2O3
Molecular Weight
158.160000
Exact Mass
158.069142
InChI
InChI=1S/C6H10N2O3/c7-6(11)8-3-1-2-4(8)5(9)10/h4H,1-3H2,(H2,7,11)(H,9,10)/t4-/m0/s1
InChIKey
RTNFBJXLYMERBB-BYPYZUCNSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.67
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
36.95
TPSA
83.63

LogP / Solubility

WLOGP
-0.39
MLOGP
-0.34
XLogP3
-0.5
Consensus LogP
-0.41
Log S (ESOL)
-0.51
Class (ESOL)
Very soluble
Log S (Ali)
-0.58
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.49
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
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)
-3.96

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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