UCSF

ZINC09380516

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2007 38 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) 6.42 14.93 -44.98 2 6 1 71 521.722 12
Mid Mid (pH 6-8) 5.84 3.03 -54.88 1 6 1 68 521.722 12

Activity (Go SEA)

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