UCSF

ZINC36159858

Substance Information

In ZINC since Heavy atoms Benign functionality
October 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) -1.55 -2.01 -60.68 4 7 1 103 275.354 4
Mid Mid (pH 6-8) -1.55 -4.15 -16.81 3 7 0 101 274.346 4

Activity (Go SEA)

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