UCSF

ZINC09410039

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 31 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) 1.78 8.05 -54.18 4 7 1 95 446.572 6
Mid Mid (pH 6-8) 1.78 8.51 -116.12 5 7 2 96 447.58 6

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