UCSF

ZINC03954983

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2005 28 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) 0.15 -1.91 -13.61 1 8 0 99 377.404 3
Lo Low (pH 4.5-6) 0.15 -1.8 -41.32 2 8 1 100 378.412 3

Activity (Go SEA)

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