UCSF

ZINC00196092

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 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) 1.06 -2.16 -10.58 2 5 0 65 241.25 1
Hi High (pH 8-9.5) 1.25 -1.66 -62.14 1 5 -1 71 240.242 1

Activity (Go SEA)

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