UCSF

ZINC04713344

Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2005 22 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) 4.00 8.48 -39.15 2 3 1 37 295.406 2
Hi High (pH 8-9.5) 4.00 6.84 -5.62 1 3 0 36 294.398 2

Activity (Go SEA)

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