Ligand id: 2774

Name: trabectedin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 4
Topological polar surface area 194.02
Molecular weight 761.26
XLogP 1.69
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. D'Incalci M, Galmarini CM. (2010)
A review of trabectedin (ET-743): a unique mechanism of action.
Mol. Cancer Ther., 9 (8): 2157-63. [PMID:20647340]
2. Synold TW, Dussault I, Forman BM. (2001)
The orphan nuclear receptor SXR coordinately regulates drug metabolism and efflux.
Nat. Med., 7 (5): 584-90. [PMID:11329060]