UCSF

ZINC34625343

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 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) 1.16 10.04 -56.3 1 4 -1 69 320.434 6
Hi High (pH 8-9.5) 1.16 10.57 -109.05 1 4 -2 69 319.426 6

Activity (Go SEA)

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