UCSF

ZINC67954745

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 24 Yes

Popular Name: N-cyclopropyl-2-(11-oxo-3,7,10-triazaspiro[5.5]undecan-3-yl)pyridine-4-carboxamide N-cyclopropyl-2-(11-oxo-3,7,10-t…

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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) -0.14 2.81 -53.79 4 7 1 91 330.412 3 ↓
Mid Mid (pH 6-8) -0.14 1.65 -13.69 3 7 0 86 329.404 3 ↓
Lo Low (pH 4.5-6) -0.14 3.16 -102.56 5 7 2 92 331.42 3 ↓

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

No pre-computed analogs available. Try a structural similarity search.