UCSF

ZINC01298923

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 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) 3.79 8.75 -17.13 2 8 0 102 476.92 7
Ref Reference (pH 7) 3.79 8.62 -22.27 2 8 0 102 476.92 7

Activity (Go SEA)

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