UCSF

ZINC15912083

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 25 Yes

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 10.17 -20.26 2 5 0 64 328.375 1
Mid Mid (pH 6-8) 3.40 10.71 -34.72 3 5 1 65 329.383 1

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

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