UCSF

ZINC00734768

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 29 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) 3.28 5.73 -10.92 1 7 0 73 435.311 6
Mid Mid (pH 6-8) 3.28 8 -51.25 2 7 1 74 436.319 6

Activity (Go SEA)

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