UCSF

ZINC08430838

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 22 Yes

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) 2.94 10.01 -43.03 2 3 1 34 297.422 7
Hi High (pH 8-9.5) 2.94 7.54 -7.02 1 3 0 32 296.414 7

Activity (Go SEA)

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