UCSF

ZINC19731715

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 28 Yes

Popular Name: 1-[(5R)-5-[(2,3-dimethylimidazol-4-yl)methylamino]-7,7-dimethyl-6,8-dihydro-5H-quinazolin-2-yl]piper 1-[(5R)-5-[(2,3-dimethylimidazol…

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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) 0.31 6.68 -77.72 4 7 2 82 386.544 4 ↓
Hi High (pH 8-9.5) 0.31 5.9 -13.62 2 7 0 79 384.528 4 ↓
Mid Mid (pH 6-8) 0.31 6.33 -39.07 3 7 1 80 385.536 4 ↓
Lo Low (pH 4.5-6) 0.31 7.99 -191.19 5 7 3 86 387.552 4 ↓
Lo Low (pH 4.5-6) 0.31 8.51 -81.05 4 7 2 82 386.544 4 ↓

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

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