UCSF

ZINC22688212

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 28 Yes

Popular Name: 3-(1-isopropyl-4,6-dimethyl-pyrazolo[4,5-e]pyridin-5-yl)-N-(3-morpholinopropyl)propanamide 3-(1-isopropyl-4,6-dimethyl-pyra…

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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) 2.23 6.05 -15.06 1 7 0 72 387.528 8 ↓
Mid Mid (pH 6-8) 2.23 8.38 -53 2 7 1 73 388.536 8 ↓

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

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