UCSF

ZINC58638539

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2011 49 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) 9.18 25.82 -70 3 9 0 139 709.946 36
Hi High (pH 8-9.5) 9.18 25.43 -51.24 2 9 -1 137 708.938 36

Activity (Go SEA)

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