UCSF

ZINC32015967

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 15 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) 0.62 -0.9 -52.42 5 4 1 69 231.703 5
Hi High (pH 8-9.5) 0.62 -1.48 -5.79 4 4 0 68 230.695 5

Activity (Go SEA)

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