UCSF

ZINC06117565

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2006 15 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 0.93 1.8 -14.74 2 5 0 80 205.169 1
Hi High (pH 8-9.5) 0.93 3.02 -51.78 1 5 -1 82 204.161 1

Activity (Go SEA)

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