UCSF

ZINC06756670

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2006 14 No

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) 0.50 1.47 -10.19 2 6 0 102 213.218 4
Lo Low (pH 4.5-6) 0.50 1.75 -45.81 3 6 1 103 214.226 4

Activity (Go SEA)

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