UCSF

ZINC60022808

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 33 No

Popular Name: 1-[(1S)-1-methyl-2-[4-(p-tolyl)piperazin-1-yl]ethyl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one 1-[(1S)-1-methyl-2-[4-(p-tolyl)p…

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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) 1.18 12.23 -38.12 1 5 1 36 441.599 5 ↓
Lo Low (pH 4.5-6) 1.18 14.23 -125.25 2 5 2 37 442.607 5 ↓

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

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