UCSF

ZINC35303975

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 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) -0.20 4.93 -34.54 2 5 0 74 230.308 6
Hi High (pH 8-9.5) -0.20 2.68 -55.54 1 5 -1 72 229.3 6

Activity (Go SEA)

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