UCSF

ZINC16428674

Substance Information

In ZINC since Heavy atoms Benign functionality
August 28th, 2008 31 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) 3.25 2.96 -23.88 4 10 0 164 480.549 8
Hi High (pH 8-9.5) 3.25 3.03 -48.14 3 10 -1 166 479.541 8

Activity (Go SEA)

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