UCSF

ZINC29397214

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2009 18 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) -2.09 -3.05 -34.69 3 8 0 122 256.214 3
Hi High (pH 8-9.5) -1.63 -4.84 -75.83 2 8 -1 125 255.206 3

Activity (Go SEA)

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