UCSF

ZINC13418725

Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 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) 3.97 7.74 -62.42 1 5 -1 78 339.154 5

Activity (Go SEA)

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