UCSF

ZINC20420670

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 12 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) -0.85 -0.16 -42.21 5 4 1 74 190.292 5
Hi High (pH 8-9.5) -0.85 -2.45 -15.06 4 4 0 72 189.284 5

Activity (Go SEA)

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