UCSF

ZINC36637772

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 34 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) 6.82 14.36 -44.91 1 6 1 56 484.686 14
Hi High (pH 8-9.5) 6.82 12.68 -9.65 0 6 0 55 483.678 14

Activity (Go SEA)

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