UCSF

ZINC49512274

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.20 9.89 -53.77 2 4 1 37 397.301 5
Mid Mid (pH 6-8) 4.20 7.69 -9.16 1 4 0 36 396.293 5

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

No pre-computed analogs available. Try a structural similarity search.