UCSF

ZINC21519135

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 18 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) -0.40 -2.36 -30.96 5 6 0 115 287.366 6
Hi High (pH 8-9.5) -0.40 -2.79 -55.93 4 6 -1 117 286.358 6

Activity (Go SEA)

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