UCSF

ZINC51735675

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2010 24 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) 0.84 3.99 -38.53 4 7 1 97 341.476 10
Hi High (pH 8-9.5) 0.84 2.6 -21.81 3 7 0 96 340.468 10

Activity (Go SEA)

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