UCSF

ZINC48048667

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2010 20 No

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) 0.19 1.86 -41.11 4 7 1 97 285.368 8
Hi High (pH 8-9.5) 0.19 -0.14 -14.44 3 7 0 96 284.36 8

Activity (Go SEA)

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