UCSF

ZINC24334077

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2009 35 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) 4.07 12.51 -72.36 1 7 0 77 479.621 11
Hi High (pH 8-9.5) 4.07 10.2 -61 0 7 -1 76 478.613 11

Activity (Go SEA)

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