UCSF

ZINC15257384

Substance Information

In ZINC since Heavy atoms Benign functionality
July 22nd, 2008 32 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) 0.86 4.77 -21.18 1 8 0 76 455.481 6
Lo Low (pH 4.5-6) 0.86 6.92 -60.28 2 8 1 77 456.489 6

Activity (Go SEA)

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