UCSF

ZINC20358333

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 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) -1.28 11.58 -79.39 4 8 2 98 422.533 6
Hi High (pH 8-9.5) -1.28 9.3 -27.91 3 8 1 97 421.525 6

Activity (Go SEA)

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