UCSF

ZINC23316709

Substance Information

In ZINC since Heavy atoms Benign functionality
December 29th, 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) 1.90 5.4 -13.3 1 8 0 81 409.49 7
Mid Mid (pH 6-8) 1.90 7.68 -52.46 2 8 1 82 410.498 7

Activity (Go SEA)

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