UCSF

ZINC10249115

Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2007 31 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) 2.76 -4.49 -11.66 1 9 0 101 443.577 6
Mid Mid (pH 6-8) 2.76 -4.19 -40.17 2 9 1 102 444.585 6

Activity (Go SEA)

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