UCSF

ZINC65501072

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 25 Yes

Popular Name: 5-isopropyl-N-[3-(3-pyridyl)propyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxamide 5-isopropyl-N-[3-(3-pyridyl)prop…

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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) 1.75 7.29 -46.84 2 6 1 64 342.467 6 ↓
Hi High (pH 8-9.5) 1.75 5.39 -12.44 1 6 0 63 341.459 6 ↓
Lo Low (pH 4.5-6) 1.75 7.76 -83.91 3 6 2 65 343.475 6 ↓

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

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