UCSF

ZINC37816525

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 20 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) 1.07 5.84 -13.54 1 5 0 59 294.376 6
Mid Mid (pH 6-8) 1.07 6.94 -40.81 2 5 1 63 295.384 6

Activity (Go SEA)

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