UCSF

ZINC30287477

Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2009 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) 0.46 4.38 -51.5 3 5 1 63 268.381 6
Hi High (pH 8-9.5) 0.46 2.03 -15.99 2 5 0 61 267.373 6

Activity (Go SEA)

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