UCSF

ZINC09241501

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 33 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) 5.69 1.16 -9.93 0 4 0 46 449.579 6
Lo Low (pH 4.5-6) 5.69 1.27 -33.06 1 4 1 47 450.587 6

Activity (Go SEA)

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