UCSF

ZINC34405702

Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2009 27 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) -1.56 4.29 -73.55 4 8 0 126 375.425 6
Hi High (pH 8-9.5) -1.56 3.03 -67.41 3 8 -1 122 374.417 6

Activity (Go SEA)

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