UCSF

ZINC19833568

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 18 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) 0.97 6.35 -53.11 2 4 1 61 262.358 4
Mid Mid (pH 6-8) 0.97 5 -11.97 1 4 0 56 261.35 4

Activity (Go SEA)

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