UCSF

ZINC00087836

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 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) 3.40 4.11 -9.25 0 5 0 67 284.193 4
Lo Low (pH 4.5-6) 3.40 4.22 -47.3 1 5 1 69 285.201 4

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

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