UCSF

ZINC00699434

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 35 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) 1.71 8.68 -23.29 1 9 0 101 502.568 7
Hi High (pH 8-9.5) 1.52 7.6 -50.94 0 9 -1 107 501.56 7

Activity (Go SEA)

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