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CAS 352438-84-7 S(+)-2-AMINO-1-PROPANOL-3,3,3-D3 molecular structure lightbox
CAS RN: 352438-84-7

S(+)-2-AMINO-1-PROPANOL-3,3,3-D3

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250325 100mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS352438-84-7
  • Purity/Analytical Methods: >99.0%
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352438-84-7 / 2-aminopropan-1-ol

Standard CAS: 352438-84-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
352438-84-7
Multi CAS
Yes
Molecular Formula
C3H9NO
Molecular Weight
75.110000
Exact Mass
75.068414
InChI
InChI=1S/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m0/s1/i1D3
InChIKey
BKMMTJMQCTUHRP-SRQSVDBESA-N

Computed Properties

Structural Parameters

Heavy atom count
5
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
20.74
TPSA
46.25

LogP / Solubility

WLOGP
-0.67
MLOGP
-0.61
XLogP3
-1
Consensus LogP
-0.76
Log S (ESOL)
0.18
Class (ESOL)
Highly soluble
Log S (Ali)
0.31
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.29
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-3.66

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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