UCSF

ZINC00152195

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 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) 3.30 -3.24 -11.41 1 4 0 59 296.779 4
Hi High (pH 8-9.5) 3.30 -2.67 -46.06 0 4 -1 61 295.771 4

Activity (Go SEA)

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