UCSF

ZINC34885606

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 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) -1.53 -2.04 -69.11 8 10 1 156 371.443 7
Hi High (pH 8-9.5) -0.81 -2.45 -85.65 7 10 0 153 370.435 7

Activity (Go SEA)

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