UCSF

ZINC41436575

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2010 28 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) 3.50 11.58 -16.17 0 5 0 69 371.392 5
Lo Low (pH 4.5-6) 3.50 12.06 -45.42 1 5 1 71 372.4 5

Activity (Go SEA)

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