UCSF

ZINC16679618

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 27 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.53 2.84 -50.92 2 8 1 105 418.561 8
Hi High (pH 8-9.5) 1.53 1.19 -20.97 1 8 0 104 417.553 8

Activity (Go SEA)

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