UCSF

ZINC65501966

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 25 No

Popular Name: (3aR)-N-cyclopropyl-5-[[(3R)-5-isobutyl-3H-pyrazol-3-yl]methyl]-3a,4,6,7-tetrahydro-1H-pyrazolo[1,5- (3aR)-N-cyclopropyl-5-[[(3R)-5-i…

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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) 1.94 1.93 -10.12 2 7 0 72 344.463 6 ↓
Lo Low (pH 4.5-6) 1.94 4.19 -45.84 3 7 1 74 345.471 6 ↓

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

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