UCSF

ZINC25915928

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2009 24 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) 0.86 4.25 -52.14 4 7 1 92 335.428 9
Hi High (pH 8-9.5) 0.86 2.31 -23.1 3 7 0 91 334.42 9

Activity (Go SEA)

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