UCSF

ZINC15936872

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 28 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) 1.38 6.38 -36.01 4 11 1 142 384.424 8
Mid Mid (pH 6-8) 1.38 3.85 -10.42 3 11 0 140 383.416 8

Activity (Go SEA)

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