UCSF

ZINC40019247

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2010 38 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 5.71 14.77 -76.7 1 7 0 77 521.702 15
Lo Low (pH 4.5-6) 5.71 14.01 -51.52 2 7 1 75 522.71 15

Activity (Go SEA)

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