UCSF

ZINC35499824

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 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) 4.33 12.8 -36.77 1 3 1 19 367.488 10
Hi High (pH 8-9.5) 4.33 12.44 -5.65 0 3 0 17 366.48 10

Activity (Go SEA)

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