methyl 2-[[(2R,3R)-3-[(2S)-1-[(3R,4S)-4-[[(2S)-2-[[(2S)-2-[[4-[[5-(carbamoylamino)-2-[[(2S)-3-methyl-2-[[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]acetyl]amino]butanoyl]amino]pentanoyl]amino]phenyl]methoxycarbonyl-methylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• 英文名称: methyl 2-[[(2R,3R)-3-[(2S)-1-[(3R,4S)-4-[[(2S)-2-[[(2S)-2-[[4-[[5-(carbamoylamino)-2-[[(2S)-3-methyl-2-[[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]acetyl]amino]butanoyl]amino]pentanoyl]amino]phenyl]methoxycarbonyl-methylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate
• 化学式: C₆₈H₁₀₆N₁₀O₁₇
• 分子量: 1335.6
• InChiKey: FCOUACVUZHSHRP-BAHISBHJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  95
• 可旋转键数：
  44
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  343
• 氢给体数：
  7
• 氢受体数：
  17

文献信息

• ANTIBODY-ACTIVE AGENT CONJUGATES AND METHODS OF USE
  申请人：LegoChem Biosciences, Inc.

  公开号：US20140161829A1

  公开（公告）日：2014-06-12

  The invention provides protein-active agent conjugates having an amino acid motif that can be recognized by an isoprenoid transferase. The invention also provides compositions containing the conjugates. The invention further provides methods for using the conjugates to deliver the active agent to a target cell, as well as methods for using the conjugates to treat a subject in need thereof (e.g., a subject in need of the active agent).
• Methods of preparing antibody-active agent conjugates
  申请人：LegoChem Biosciences, Inc.

  公开号：US20140187756A1

  公开（公告）日：2014-07-03

  The invention provides methods for preparing an antibody-active agent conjugate. The conjugate comprises an antibody, a cysteine residue of an amino acid motif that can be recognized by an isoprenoid transferase located at or after the carboxy-terminus of the antibody, an isoprenoid unit operably linked to the cysteine residue, and an active agent. The invention also provides a composition comprising the antibody-active agent conjugate prepared by the methods.
• PROTEIN-ACTIVE AGENT CONJUGATES AND METHODS OF USE
  申请人：Kim Yong Zu

  公开号：US20160213786A1

  公开（公告）日：2016-07-28

  The invention provides methods for preparing an antibody-active agent conjugate. The conjugate comprises an antibody, a cysteine residue of an amino acid motif that can be recognized by an isoprenoid transferase located at or after the carboxy-terminus of the antibody, an isoprenoid unit operably linked to the cysteine residue, and an active agen. The invention also provides a composition comprising the antibody-active agent conjugate prepared by the methods.
• US9669107B2
  申请人：——

  公开号：US9669107B2

  公开（公告）日：2017-06-06