UCSF

ZINC49177252

Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2010 20 No

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) 3.07 7.68 -7.7 0 5 0 58 278.352 3
Lo Low (pH 4.5-6) 3.07 9.16 -48.09 1 5 1 59 279.36 3

Activity (Go SEA)

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