UCSF

ZINC07708235

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2006 26 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) 3.25 -3.76 -16.86 1 5 0 66 366.442 4
Hi High (pH 8-9.5) 3.25 -3.19 -54.15 0 5 -1 68 365.434 4

Activity (Go SEA)

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