UCSF

ZINC34623513

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 15 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) -3.73 1.5 -56.09 2 7 -1 114 220.201 9
Hi High (pH 8-9.5) -3.73 -0.59 -113.5 1 7 -2 113 219.193 9

Activity (Go SEA)

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