UCSF

ZINC22162759

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 16 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) 2.01 3.48 -57.95 2 3 1 51 246.396 2
Hi High (pH 8-9.5) 2.01 2.31 -9.69 1 3 0 46 245.388 2

Activity (Go SEA)

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