UCSF

ZINC26391924

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 27 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.40 7.57 -15.33 2 6 0 65 374.529 7
Lo Low (pH 4.5-6) 3.40 9.73 -54.28 3 6 1 66 375.537 7

Activity (Go SEA)

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