UCSF

ZINC27020493

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 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) 4.63 12.62 -25.44 0 6 0 67 471.582 6
Mid Mid (pH 6-8) 4.63 14.9 -65.91 1 6 1 68 472.59 6

Activity (Go SEA)

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