UCSF

ZINC36636397

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 26 Yes

Other Names:

MFCD12968343

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) 3.44 6.92 -10.98 0 5 0 50 374.506 6
Mid Mid (pH 6-8) 3.44 9.14 -47.8 1 5 1 51 375.514 6

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

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