UCSF

ZINC10556731

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2007 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.09 -3.96 -13.36 2 6 0 88 419.503 6
Hi High (pH 8-9.5) 4.09 -3.38 -36.54 1 6 -1 90 418.495 6

Activity (Go SEA)

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