UCSF

ZINC37335109

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 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) 1.32 0.18 -34.46 0 5 -1 75 257.147 2
Mid Mid (pH 6-8) 0.86 2.85 -7.04 1 5 0 72 258.155 2

Activity (Go SEA)

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