UCSF

ZINC01851106

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 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) 5.61 9.18 -8.04 1 3 0 45 377.238 2
Ref Reference (pH 7) 5.61 8.77 -7.54 1 3 0 45 377.238 2

Activity (Go SEA)

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