UCSF

ZINC35550765

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 33 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 4.11 11.82 -35.82 1 7 1 69 447.559 5
Mid Mid (pH 6-8) 4.11 11.5 -13.12 0 7 0 68 446.551 5

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