UCSF

ZINC06633023

Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2006 30 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) 2.70 9.12 -11.94 1 6 0 84 402.381 2
Lo Low (pH 4.5-6) 2.70 9.33 -37.94 2 6 1 85 403.389 2

Activity (Go SEA)

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