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CAS 474645-27-7 MonoMethyl auristatin E molecular structure lightbox
CAS RN: 474645-27-7

MonoMethyl auristatin E

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17 package records14 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260319 1ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251104 100mg In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250608 10g In stock Shanghai Inquiry
Batchno.20260302 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250308 1mg In stock Shanghai Inquiry
Batchno.20250822 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250823 25g In stock Shanghai, Wuhan Inquiry
Batchno.20250426 50mg In stock Shanghai Inquiry
Batchno.20250415 5g In stock Shanghai, Shenzhen Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250509 100mg In stock Inquiry
Batchno.20260507 10mg In stock Inquiry
Batchno.20260509 1g Out of stock Inquiry
Batchno.20260514 250mg Out of stock Inquiry
Batchno.20250502 25mg In stock Inquiry
Batchno.20260226 50mg In stock Inquiry
Batchno.20250428 5g Out of stock Inquiry
Batchno.20251231 5mg In stock Inquiry
  • Product code: SSC-154392
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 0.1g, 5g, 10g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 474645-27-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >95% 4 In Stock Shenzhen Inquiry
1g >95% 4 In Stock Beijing Inquiry
0.1g >95% 1 In Stock Beijing Inquiry
5g >95% 0 Out of Stock Hong Kong Inquiry
10g >95% 0 Out of Stock Beijing Inquiry

474645-27-7 / (2S)-N-[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-3-methyl-2-(methylamino)butanamide

Standard CAS: 474645-27-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
474645-27-7
Multi CAS
Yes
Molecular Formula
C39H67N5O7
Molecular Weight
718.000000
Exact Mass
717.504049
InChI
InChI=1S/C39H67N5O7/c1-13-25(6)34(43(10)39(49)33(24(4)5)42-38(48)32(40-9)23(2)3)30(50-11)22-31(45)44-21-17-20-29(44)36(51-12)26(7)37(47)41-27(8)35(46)28-18-15-14-16-19-28/h14-16,18-19,23-27,29-30,32-36,40,46H,13,17,20-22H2,1-12H3,(H,41,47)(H,42,48)/t25-,26+,27+,29-,30+,32-,33-,34-,35+,36+/m0/s1
InChIKey
DASWEROEPLKSEI-UIJRFTGLSA-N

Computed Properties

Structural Parameters

Heavy atom count
51
Aromatic heavy atom count
6
Fraction Csp3
0.74
Rotatable bonds
20
H-bond acceptors
8
H-bond donors
4
Molar refractivity
199.58
TPSA
149.54

LogP / Solubility

WLOGP
3.53
MLOGP
3.17
XLogP3
4.1
Consensus LogP
3.6
Log S (ESOL)
-5.28
Class (ESOL)
Slightly soluble
Log S (Ali)
-8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.66
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.59

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
9

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