UCSF

ZINC37806074

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 17 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 0.83 5.07 -41.17 2 4 1 50 253.347 4
Mid Mid (pH 6-8) 0.83 3.94 -9.81 1 4 0 45 252.339 4

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