UCSF

ZINC03632626

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 21 No

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) 4.39 10 -44.86 2 3 1 26 309.499 11
Hi High (pH 8-9.5) 4.39 7.89 -10.09 1 3 0 24 308.491 11

Activity (Go SEA)

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