UCSF

ZINC12302309

Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2008 27 Yes

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 12.13 -44.57 1 5 1 43 367.517 4
Mid Mid (pH 6-8) 1.90 12.59 -100.6 2 5 2 44 368.525 4

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