UCSF

ZINC26516460

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 14 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) 1.66 5.09 -16.57 1 3 0 38 192.193 1
Mid Mid (pH 6-8) 2.11 3.29 -11.16 1 3 0 38 192.193 1

Activity (Go SEA)

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