UCSF

ZINC27381950

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2009 27 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) 3.86 10.01 -47.08 2 7 1 83 369.445 5
Hi High (pH 8-9.5) 3.86 7.76 -9.51 1 7 0 81 368.437 5

Activity (Go SEA)

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