UCSF

ZINC32122678

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 20 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) 3.49 9.56 -84.08 3 3 2 30 278.44 7
Hi High (pH 8-9.5) 3.49 6.97 -42.11 2 3 1 29 277.432 7

Activity (Go SEA)

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