UCSF

ZINC22065499

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 21 Yes

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) 0.26 -2.4 -33.86 5 6 1 95 306.423 10
Hi High (pH 8-9.5) 0.26 -1.78 -44.82 4 6 0 97 305.415 10

Activity (Go SEA)

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