Submission Details

STE-UNK-a3cce3f2
Molecule(s):
C#Cc1c(Cc2cc(C)cc3ccnnc23)nc(-c2cnccc2C)c2n[nH]c(C)c12

STE-UNK-a3cce3f2-1

C#Cc1c(Cc2cc(C)cc3ccnnc23)nc(-c2cnccc2C)c2n[nH]c(C)c12

Design Rationale:

Follow-up for STE-UNK-dfa. Cinnoline moiety to address Asn142. Fusion of pyrazol into bicyclic system might deteriorate optimal geometry of initial starting point from STE-UNK-dfa.

Inspired By:
Download PDB File
Discussion:

Contributor: Steffen Glöckner - Sun, 29 Mar 2020 12:19:38 +0000