UCSF

ZINC35499547

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 21 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) 4.01 10.95 -4.58 0 2 0 8 284.378 8
Mid Mid (pH 6-8) 4.01 12.03 -38.24 1 2 1 9 285.386 8

Activity (Go SEA)

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