UCSF

ZINC23324507

Substance Information

In ZINC since Heavy atoms Benign functionality
December 29th, 2008 33 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) 4.82 11.19 -15.39 2 7 0 78 463.969 5
Mid Mid (pH 6-8) 4.82 11.53 -45.31 3 7 1 79 464.977 5

Activity (Go SEA)

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