UCSF

ZINC35216108

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 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) 0.72 4.72 -34.6 1 3 1 25 199.318 4
Hi High (pH 8-9.5) 0.72 2.29 -5.41 0 3 0 24 198.31 4

Activity (Go SEA)

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