UCSF

ZINC67742743

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 30 Yes

Popular Name: N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-1-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidi N-[(3R,4R)-4-hydroxypyrrolidin-3…

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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) 2.10 6.23 -53.44 4 7 1 95 408.526 4 ↓
Hi High (pH 8-9.5) 2.10 4.77 -19.73 3 7 0 90 407.518 4 ↓
Mid Mid (pH 6-8) 2.10 6.56 -82.4 5 7 2 96 409.534 4 ↓

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

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