UCSF

ZINC21698063

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2008 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) 1.75 8.94 -43.14 3 6 1 68 379.484 7
Hi High (pH 8-9.5) 1.75 6.57 -8.77 2 6 0 66 378.476 7

Activity (Go SEA)

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