UCSF

ZINC34337192

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 17 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) -2.57 7.77 -48.83 1 5 -1 85 234.231 4
Hi High (pH 8-9.5) -2.57 4.92 -109.66 0 5 -2 83 233.223 4

Activity (Go SEA)

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