UCSF

ZINC20737932

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 30 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) 3.29 10.3 -16.44 1 7 0 85 421.526 4
Ref Reference (pH 7) 3.11 12.75 -15.6 1 7 0 82 421.526 4

Activity (Go SEA)

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