UCSF

ZINC26154228

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 25 Yes

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) 3.61 8.8 -33.6 3 5 1 63 346.495 7
Hi High (pH 8-9.5) 3.61 6.61 -10.93 2 5 0 61 345.487 7

Activity (Go SEA)

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