UCSF

ZINC37186450

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 15 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) 1.97 5.82 -38.03 2 2 1 26 224.349 4
Hi High (pH 8-9.5) 1.97 5.01 -3.05 1 2 0 21 223.341 4

Activity (Go SEA)

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