UCSF

ZINC19453673

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 32 Yes

Popular Name: 2-isopropyl-4-morpholino-7-[(2,4,5-trimethoxyphenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 2-isopropyl-4-morpholino-7-[(2,4…

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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) 2.49 6.29 -32.26 1 8 1 70 443.568 7 ↓
Hi High (pH 8-9.5) 2.49 5.94 -11.47 0 8 0 69 442.56 7 ↓
Mid Mid (pH 6-8) 2.49 8.73 -110.68 2 8 2 72 444.576 7 ↓
Lo Low (pH 4.5-6) 2.49 8.37 -48.13 1 8 1 70 443.568 7 ↓

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Rings

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

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