UCSF

ZINC20883686

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 31 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 2.24 8.02 -45.95 5 7 1 94 418.521 8
Hi High (pH 8-9.5) 2.24 5.8 -11.96 4 7 0 93 417.513 8

Activity (Go SEA)

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