UCSF

ZINC06355724

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 34 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) 3.41 10.97 -62.98 0 8 -1 105 464.494 10
Mid Mid (pH 6-8) 3.41 10.07 -16.27 1 8 0 102 465.502 10

Activity (Go SEA)

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