UCSF

ZINC16778373

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2008 32 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) 5.52 10.23 -51.07 1 9 -1 132 448.484 6
Lo Low (pH 4.5-6) 5.52 10.44 -18.14 2 9 0 130 449.492 6

Activity (Go SEA)

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