UCSF

ZINC08992293

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 25 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) 0.70 2.84 -55.14 2 8 1 103 386.475 5
Hi High (pH 8-9.5) 0.70 2.92 -18.57 1 8 0 101 385.467 5

Activity (Go SEA)

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