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CAS 76420-72-9 Enalaprilat molecular structure lightbox
CAS RN: 76420-72-9

Enalaprilat

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5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260611 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250914 1g In stock Shanghai Inquiry
Batchno.20260108 250mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251014 250mg In stock Shanghai Inquiry
Batchno.20260113 50mg In stock Shanghai, Shandong, Hebei Inquiry
  • Product code: starshine_CAS76420-72-9
  • Purity/Analytical Methods: >99.0%
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76420-72-9 / 1-[2-[(1-carboxy-3-phenylpropyl)amino]propanoyl]pyrrolidine-2-carboxylic acid

Standard CAS: 76420-72-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
76420-72-9
Multi CAS
Yes
Molecular Formula
C18H24N2O5
Molecular Weight
348.400000
Exact Mass
348.168522
InChI
InChI=1S/C18H24N2O5/c1-12(16(21)20-11-5-8-15(20)18(24)25)19-14(17(22)23)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15,19H,5,8-11H2,1H3,(H,22,23)(H,24,25)
InChIKey
LZFZMUMEGBBDTC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
8
H-bond acceptors
4
H-bond donors
3
Molar refractivity
91.16
TPSA
106.94

LogP / Solubility

WLOGP
1.13
MLOGP
1.01
XLogP3
-0.7
Consensus LogP
0.48
Log S (ESOL)
-2.36
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.23
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.82
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.05

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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