UCSF

ZINC19453721

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 26 Yes

Popular Name: 7-benzyl-2-isopropyl-4-morpholino-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 7-benzyl-2-isopropyl-4-morpholin…

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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) 2.86 7.44 -29.95 1 5 1 43 353.49 4 ↓
Hi High (pH 8-9.5) 2.86 7.07 -6.65 0 5 0 41 352.482 4 ↓
Mid Mid (pH 6-8) 2.86 9.82 -113.66 2 5 2 44 354.498 4 ↓
Lo Low (pH 4.5-6) 2.86 9.45 -47.64 1 5 1 43 353.49 4 ↓

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

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