UCSF

ZINC34678734

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 25 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) 0.81 0.64 -48.38 3 7 1 84 345.423 7
Hi High (pH 8-9.5) 0.81 -0.71 -9.97 2 7 0 80 344.415 7

Activity (Go SEA)

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