UCSF

ZINC37019386

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2009 18 Yes

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) -0.10 -1.51 -52.99 5 6 1 103 272.35 5
Hi High (pH 8-9.5) -0.10 -1.84 -13.5 4 6 0 101 271.342 5

Activity (Go SEA)

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