UCSF

ZINC31963564

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 18 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) 1.08 3.72 -55.89 4 4 1 70 266.321 4
Hi High (pH 8-9.5) 1.27 2.57 -54.91 3 4 0 76 265.313 4

Activity (Go SEA)

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