UCSF

ZINC05485265

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 26 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) 3.52 10.17 -30.32 1 8 0 114 370.39 7
Hi High (pH 8-9.5) 3.52 10 -49.19 0 8 -1 112 369.382 7

Activity (Go SEA)

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