UCSF

ZINC34858434

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 26 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) 3.58 6.83 -34.77 2 6 0 88 371.462 6
Hi High (pH 8-9.5) 3.58 6.42 -51.84 1 6 -1 90 370.454 6

Activity (Go SEA)

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