Name: Mal-Phe-C4-Val-Cit-PAB
Rating: 5 (10 reviews)

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HIT ID:HIT212667973
Cas No:
常用名:Mal-Phe-C4-Val-Cit-PAB
IUPAC:(2S)-5-(carbamoylamino)-2-[(2S)-2-{4-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]butanamido}-3-methylbutanamido]-N-[4-(hydroxymethyl)phenyl]pentanamide
IUPAC:(2S)-5-(carbamoylamino)-2-[(2S)-2-{4-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]butanamido}-3-methylbutanamido]-N-[4-(hydroxymethyl)phenyl]pentanamide
InChI key:AJKAEJUDCVBLSZ-SVEHJYQDSA-N

分子式:C32H40N6O7
分子量:620.707
氢键供体数 (HBD):6
氢键受体数 (HBA):7
LogP:1.1628582
SMILES:CC(C)[C@H](NC(=O)CCCc1ccc(cc1)N1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1 |c:20|
SMILES:CC(C)[C@H](NC(=O)CCCc1ccc(cc1)N1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1 |c:20|

Mal-Phe-C4-Val-Cit-PAB is a cleavable antibody-drug conjugate (ADC) linker featuring a Maleimide functional group. It is employed in the synthesis of ADCs.

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