UCSF

ZINC15920122

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 28 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) 3.03 8.36 -65.77 1 5 -1 81 376.432 7
Lo Low (pH 4.5-6) 3.03 7.45 -15.93 2 5 0 78 377.44 7

Activity (Go SEA)

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