UCSF

ZINC15276754

Substance Information

In ZINC since Heavy atoms Benign functionality
July 22nd, 2008 34 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) -0.06 7.53 -38.1 5 9 0 157 459.458 5
Hi High (pH 8-9.5) -0.06 8.36 -59.45 4 9 -1 160 458.45 5
Mid Mid (pH 6-8) -0.06 5.87 -60.79 4 9 -1 153 458.45 5

Activity (Go SEA)

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