UCSF

ZINC44250245

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 15 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) 1.90 3.58 -8.66 2 4 0 72 220.15 3
Mid Mid (pH 6-8) 1.90 3.99 -66.75 3 4 1 73 221.158 3

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