UCSF

ZINC32188618

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 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) 1.86 8.87 -34.65 3 4 0 73 288.391 7
Hi High (pH 8-9.5) 1.86 7.96 -47.37 2 4 -1 68 287.383 7

Activity (Go SEA)

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