UCSF

ZINC18117231

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2008 33 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) 4.58 11.12 -15.38 2 6 0 82 463.965 6
Ref Reference (pH 7) 4.58 11.05 -14.97 2 6 0 82 463.965 6

Activity (Go SEA)

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