UCSF

ZINC06792799

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2006 28 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) 3.60 5.52 -14.99 1 6 0 81 390.468 6
Lo Low (pH 4.5-6) 3.60 5.9 -34.28 2 6 1 82 391.476 6

Activity (Go SEA)

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