UCSF

ZINC34875222

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 14 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) 1.36 6 -46.67 3 1 1 28 186.278 1
Hi High (pH 8-9.5) 1.36 5.67 -4.06 2 1 0 26 185.27 1

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