UCSF

ZINC22853409

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2008 30 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.35 11.74 -43.33 1 7 0 84 428.558 7
Hi High (pH 8-9.5) 4.35 9.72 -54.07 0 7 -1 83 427.55 7

Activity (Go SEA)

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