UCSF

ZINC36136979

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 14 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 2.51 -20.37 2 5 0 80 200.238 5
Hi High (pH 8-9.5) -1.10 1.41 -57.07 2 5 -1 86 199.23 5

Activity (Go SEA)

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