UCSF

ZINC04165358

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 20 No

Download: MOL2 SDF SMILES Flexibase

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) 1.66 5.56 -52.71 0 5 -1 68 274.344 2
Lo Low (pH 4.5-6) 1.48 6.75 -11.34 1 5 0 62 275.352 1

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

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