UCSF

ZINC08973145

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 35 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) 3.28 11.74 -54.39 2 9 1 117 480.541 8
Mid Mid (pH 6-8) 2.70 12.54 -64.3 1 9 1 114 480.541 8

Activity (Go SEA)

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