UCSF

ZINC34955830

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 12 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) 1.05 -0.17 -19.71 3 4 0 76 206.654 2
Lo Low (pH 4.5-6) 1.05 -0.27 -9.68 3 4 0 72 206.654 2

Activity (Go SEA)

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