UCSF

ZINC19453667

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 30 Yes

Popular Name: 7-[(2,6-dimethoxyphenyl)methyl]-2-isopropyl-4-morpholino-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 7-[(2,6-dimethoxyphenyl)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) 2.87 6.78 -27.95 1 7 1 61 413.542 6 ↓
Hi High (pH 8-9.5) 2.87 6.43 -9.15 0 7 0 60 412.534 6 ↓
Mid Mid (pH 6-8) 2.87 9.12 -96.9 2 7 2 62 414.55 6 ↓
Lo Low (pH 4.5-6) 2.87 8.76 -37.02 1 7 1 61 413.542 6 ↓

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Rings

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

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