UCSF

ZINC08991566

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 28 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) 5.01 -5.92 -13.72 2 6 0 92 394.452 5
Hi High (pH 8-9.5) 5.01 -5.34 -46.07 1 6 -1 94 393.444 5

Activity (Go SEA)

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