UCSF

ZINC35698247

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 16 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) 1.12 4.19 -45.42 0 5 -1 67 255.3 3
Mid Mid (pH 6-8) 0.66 5.54 -15.03 1 5 0 64 256.308 3

Activity (Go SEA)

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