UCSF

ZINC32158270

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 21 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) 2.88 7.66 -38.84 2 4 1 35 295.447 11
Mid Mid (pH 6-8) 2.88 6.61 -48.69 2 4 1 38 295.447 11

Activity (Go SEA)

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