UCSF

ZINC25767420

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 20 Yes

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) 2.06 4.25 -8.84 1 4 0 42 276.38 6
Mid Mid (pH 6-8) 2.06 6.53 -43.24 2 4 1 43 277.388 6

Activity (Go SEA)

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