UCSF

ZINC52311195

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2010 26 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) 1.03 8.79 -45.27 1 6 1 54 360.478 5
Hi High (pH 8-9.5) 1.03 6.95 -22.53 0 6 0 53 359.47 5

Activity (Go SEA)

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