UCSF

ZINC01286795

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 25 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) 5.35 9.76 -31.79 0 6 -1 90 393.231 4
Hi High (pH 8-9.5) 6.29 8.09 -34.61 0 6 -1 94 393.231 3

Activity (Go SEA)

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