UCSF

ZINC27416015

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2009 41 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.73 17.37 -209.2 8 6 4 85 572.923 28
Hi High (pH 8-9.5) 6.73 16 -147.88 7 6 3 80 571.915 28

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )