UCSF

ZINC07392448

Substance Information

In ZINC since Heavy atoms Benign functionality
May 27th, 2006 28 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) 2.78 11.83 -42.49 1 7 1 74 400.528 7
Hi High (pH 8-9.5) 2.78 9.53 -6.8 0 7 0 73 399.52 7

Activity (Go SEA)

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