UCSF

ZINC03303545

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 31 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) 1.79 -1.91 -26.35 1 8 0 93 442.541 7
Hi High (pH 8-9.5) 1.79 -1.41 -66.89 0 8 -1 95 441.533 7

Activity (Go SEA)

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