UCSF

ZINC27340737

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2009 30 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) 3.02 10.39 -49.5 2 10 1 134 415.426 8
Hi High (pH 8-9.5) 3.02 7.68 -10.39 1 10 0 133 414.418 8

Activity (Go SEA)

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