UCSF

ZINC38101255

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2009 13 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) -0.21 1.09 -11.95 1 4 0 42 204.295 4
Mid Mid (pH 6-8) -0.21 2.47 -40.1 2 4 1 46 205.303 4

Activity (Go SEA)

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