UCSF

ZINC69810173

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 23 Yes

Popular Name: 2-[[[(1S,2S)-1-methyl-2-(4-methylpyrazol-1-yl)propyl]amino]methyl]pyrido[1,2-a]pyrimidin-4-one 2-[[[(1S,2S)-1-methyl-2-(4-methy…

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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) 1.99 7.51 -49.51 2 6 1 69 312.397 5 ↓
Mid Mid (pH 6-8) 1.99 6.47 -14.73 1 6 0 64 311.389 5 ↓
Lo Low (pH 4.5-6) 1.99 6.91 -39.72 2 6 1 65 312.397 5 ↓

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

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