UCSF

ZINC34622847

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 17 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.12 6.87 -4.01 1 2 0 25 224.307 5
Mid Mid (pH 6-8) 3.12 7.34 -34.19 2 2 1 26 225.315 5

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