UCSF

ZINC00564569

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 16 Yes

Other Names:

MFCD04587511

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) 4.15 0.52 -10.6 0 2 0 17 273.133 1
Mid Mid (pH 6-8) 4.15 0.73 -24.21 1 2 1 18 274.141 1

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

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