UCSF

ZINC16731008

Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 36 No

Download: MOL2 SDF SMILES Flexibase

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) 4.16 9.57 -15.86 1 7 0 85 491.515 10
Mid Mid (pH 6-8) 3.58 10.27 -22.01 0 7 0 82 491.515 10

Activity (Go SEA)

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