UCSF

ZINC22678934

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 27 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) 3.15 8.96 -53.22 2 6 1 61 373.473 10
Hi High (pH 8-9.5) 3.15 6.87 -15.48 1 6 0 60 372.465 10

Activity (Go SEA)

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