UCSF

ZINC35610849

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 17 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) 0.04 -2.04 -44.82 2 8 -1 135 261.235 5
Mid Mid (pH 6-8) 0.04 -3.03 -13.93 3 8 0 132 262.243 5

Activity (Go SEA)

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