UCSF

ZINC10019803

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2007 26 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) 2.01 -3.16 -12.33 1 6 0 67 375.494 6
Mid Mid (pH 6-8) 2.01 -2.91 -38.42 2 6 1 68 376.502 6

Activity (Go SEA)

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