UCSF

ZINC06389816

Substance Information

In ZINC since Heavy atoms Benign functionality
March 26th, 2006 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 6.50 12.27 -10.28 1 4 0 50 411.889 3
Hi High (pH 8-9.5) 6.95 10.38 -51.69 0 4 -1 53 410.881 3

Activity (Go SEA)

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