UCSF

ZINC37994375

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 21 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) -0.08 4.41 -95.12 0 9 -2 146 316.291 6
Mid Mid (pH 6-8) -0.08 3.42 -58.02 1 9 -1 144 317.299 6

Activity (Go SEA)

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