UCSF

ZINC39762386

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 21 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 2.80 7.99 -49.15 2 5 1 59 305.427 7
Mid Mid (pH 6-8) 2.99 6.76 -51.02 1 5 0 66 304.419 7

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