UCSF

ZINC06582761

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2006 22 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) 1.75 6.78 -18.49 2 5 0 63 292.342 2
Hi High (pH 8-9.5) 2.24 6.8 -14.99 2 5 0 63 292.342 1

Activity (Go SEA)

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