UCSF

ZINC15564674

Substance Information

In ZINC since Heavy atoms Benign functionality
July 27th, 2008 28 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) 2.53 8.78 -49.25 3 6 1 72 382.484 8
Hi High (pH 8-9.5) 2.53 6.54 -12.67 2 6 0 71 381.476 8

Activity (Go SEA)

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