UCSF

ZINC08024880

Substance Information

In ZINC since Heavy atoms Benign functionality
June 28th, 2006 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.91 11.19 -11.52 0 5 0 42 378.472 3
Mid Mid (pH 6-8) 3.91 11.08 -44.5 1 5 1 43 379.48 3

Activity (Go SEA)

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