UCSF

ZINC35772996

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 20 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) 4.67 11.32 -6.02 0 2 0 16 288.822 4
Mid Mid (pH 6-8) 4.67 11.78 -23.64 1 2 1 17 289.83 4

Activity (Go SEA)

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