UCSF

ZINC41248398

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 22 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) 3.00 4.79 -9.58 1 5 0 69 296.278 1
Hi High (pH 8-9.5) 3.00 5.56 -42.13 0 5 -1 72 295.27 1

Activity (Go SEA)

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