UCSF

ZINC21531029

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 32 Yes

Popular Name: (6S)-N'-cyclopentyl-N-(2-diethylaminoethyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-d]pyrazine-2,6-d (6S)-N'-cyclopentyl-N-(2-diethyl…

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Download: MOL2 SDF SMILES Flexibase

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) 1.96 7.05 -46.98 3 9 1 101 447.604 10 ↓
Hi High (pH 8-9.5) 1.96 4.73 -13.48 2 9 0 100 446.596 10 ↓

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

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