UCSF

ZINC35605231

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 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) -0.20 -0.74 -38.73 4 4 1 66 205.303 4
Mid Mid (pH 6-8) -0.20 -1.95 -8.89 3 4 0 61 204.295 4

Activity (Go SEA)

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