UCSF

ZINC16893636

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 30 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) 5.08 7.24 -18.84 3 6 0 95 437.546 5
Hi High (pH 8-9.5) 5.54 5.99 -48.33 2 6 -1 98 436.538 5

Activity (Go SEA)

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