UCSF

ZINC18158855

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2008 34 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) 4.92 11.62 -14.64 0 7 0 68 458.514 5
Ref Reference (pH 7) 4.92 11.43 -8.49 0 7 0 68 458.514 5

Activity (Go SEA)

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