UCSF

ZINC65493031

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 26 No

Popular Name: 3-[2-[4-[(4S)-1-(o-tolyl)pyrazolidin-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethyl]-4H-imidazol-2-one 3-[2-[4-[(4S)-1-(o-tolyl)pyrazol…

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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) 2.38 9.76 -47.53 3 6 1 57 354.478 5 ↓
Mid Mid (pH 6-8) 2.38 7.48 -12.7 2 6 0 56 353.47 5 ↓
Lo Low (pH 4.5-6) 2.38 10.32 -102.74 4 6 2 62 355.486 5 ↓

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

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