UCSF

ZINC09293190

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 33 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) 4.42 -6.31 -21.73 2 8 0 114 480.571 7
Hi High (pH 8-9.5) 4.42 -5.88 -61.27 1 8 -1 116 479.563 7

Activity (Go SEA)

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