UCSF

ZINC05342034

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 17 No

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) 1.48 3.89 -10.32 1 7 0 94 234.215 2
Hi High (pH 8-9.5) 1.94 2 -36.05 0 7 -1 97 233.207 2

Activity (Go SEA)

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