UCSF

ZINC35337295

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 35 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) 2.61 17.58 -97.35 4 6 2 77 480.697 10
Hi High (pH 8-9.5) 2.61 15.47 -32.02 3 6 1 75 479.689 10

Activity (Go SEA)

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