UCSF

ZINC60022114

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 31 Yes

Popular Name: (2S)-2-(4-bromophenyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-2H-quinazoline (2S)-2-(4-bromophenyl)-1-[2-(4-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) 5.41 11.91 -46.43 2 4 1 26 478.458 5 ↓
Hi High (pH 8-9.5) 5.41 10.57 -4.33 1 4 0 22 477.45 5 ↓
Mid Mid (pH 6-8) 5.41 14.12 -111.12 3 4 2 28 479.466 5 ↓

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

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