UCSF

ZINC06786760

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 29 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) 2.67 7.95 -66.78 1 7 -1 107 394.403 7
Mid Mid (pH 6-8) 1.64 8.74 -65.69 0 7 -1 104 394.403 8

Activity (Go SEA)

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