UCSF

ZINC66739172

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2011 25 Yes

Popular Name: 7-chloro-3-methyl-1'-(4-pyridylmethyl)spiro[1H-quinazoline-2,4'-piperidine]-4-one 7-chloro-3-methyl-1'-(4-pyridylm…

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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) 1.82 7.62 -55.45 2 5 1 50 357.865 2 ↓
Mid Mid (pH 6-8) 1.82 5.37 -9.65 1 5 0 48 356.857 2 ↓

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

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