UCSF

ZINC34462585

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 24 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) 2.94 7.08 -12.87 1 6 0 82 334.368 7
Hi High (pH 8-9.5) 2.94 7.86 -54.52 0 6 -1 85 333.36 7

Activity (Go SEA)

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