UCSF

ZINC20596511

Substance Information

In ZINC since Heavy atoms Benign functionality
November 25th, 2008 9 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) 0.94 4.38 -38.82 1 2 1 22 128.195 1
Hi High (pH 8-9.5) 0.94 1.97 -5.27 0 2 0 20 127.187 1

Activity (Go SEA)

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