UCSF

ZINC34095878

Substance Information

In ZINC since Heavy atoms Benign functionality
August 11th, 2009 14 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) 2.02 5.45 -46.09 3 1 1 28 198.236 4
Hi High (pH 8-9.5) 2.02 5.05 -4.16 2 1 0 26 197.228 4

Activity (Go SEA)

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