UCSF

ZINC10157324

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2007 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) 2.06 6.59 -14.28 0 5 0 58 304.4 4
Mid Mid (pH 6-8) 2.43 4.33 -11.4 1 5 0 64 304.4 4

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

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