UCSF

ZINC67434761

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 27 Yes

Popular Name: 3-[2-(2-hydroxyphenyl)-6-methyl-pyrimidin-4-yl]-3,9-diazaspiro[5.6]dodecan-10-one 3-[2-(2-hydroxyphenyl)-6-methyl-…

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Download: MOL2 SDF SMILES Flexibase

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) 2.78 6.73 -14.52 2 6 0 78 366.465 2 ↓
Mid Mid (pH 6-8) 2.78 7.08 -35.89 3 6 1 80 367.473 2 ↓
Lo Low (pH 4.5-6) 2.78 8.08 -36.56 2 6 0 82 366.465 2 ↓

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

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