UCSF

ZINC06303621

Substance Information

In ZINC since Heavy atoms Benign functionality
March 18th, 2006 19 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) -0.74 -1.45 -10.03 3 6 0 90 262.265 2
Hi High (pH 8-9.5) -0.74 -0.91 -43.58 2 6 -1 93 261.257 2

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.