UCSF

ZINC23368784

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 28 Yes

Popular Name: (2R,3R)-1'-(4,6-dimethylpyrimidin-2-yl)-3-imidazol-1-yl-spiro[indane-1,4'-piperidine]-2-ol (2R,3R)-1'-(4,6-dimethylpyrimidi…

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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) 2.51 11.04 -40.82 2 6 1 68 376.484 2 ↓
Mid Mid (pH 6-8) 2.51 10.56 -11.98 1 6 0 67 375.476 2 ↓
Lo Low (pH 4.5-6) 2.51 11.42 -75.34 3 6 2 70 377.492 2 ↓

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

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