UCSF

ZINC35164427

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2009 35 No

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) 5.59 14.39 -75.9 1 6 0 74 478.633 14
Lo Low (pH 4.5-6) 5.59 13.63 -51.63 2 6 1 71 479.641 14

Activity (Go SEA)

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