UCSF

ZINC20885559

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) 1.47 5.74 -46.14 4 9 1 100 464.546 7
Hi High (pH 8-9.5) 1.47 3.36 -10.44 3 9 0 99 463.538 7

Activity (Go SEA)

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