UCSF

ZINC65532751

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 23 Yes

Popular Name: 4-[6-[[(2S)-tetrahydropyran-2-yl]methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]morpholine 4-[6-[[(2S)-tetrahydropyran-2-yl…

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Vendors

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) 1.19 7.96 -42.93 1 6 1 52 319.429 3 ↓
Mid Mid (pH 6-8) 1.19 6.1 -33.39 1 6 1 52 319.429 3 ↓
Mid Mid (pH 6-8) 1.19 5.69 -6.56 0 6 0 51 318.421 3 ↓
Mid Mid (pH 6-8) 1.19 8.39 -104.85 2 6 2 53 320.437 3 ↓

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

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