UCSF

ZINC00696198

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 35 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.10 10.53 -17.18 0 7 0 66 499.608 10
Mid Mid (pH 6-8) 3.10 12.88 -51.34 1 7 1 67 500.616 10

Activity (Go SEA)

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