UCSF

ZINC20884797

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 34 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) 3.15 9.87 -42.91 5 7 1 94 458.586 8
Hi High (pH 8-9.5) 3.15 7.72 -11.69 4 7 0 93 457.578 8

Activity (Go SEA)

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