UCSF

ZINC16584897

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2008 26 Yes

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) 2.69 8.01 -11.95 1 5 0 58 369.49 7
Lo Low (pH 4.5-6) 2.69 10.01 -51.46 2 5 1 59 370.498 7

Activity (Go SEA)

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