UCSF

ZINC23361901

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 34 Yes

Popular Name: 5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]pyrazole-4-c 5-cyclopropyl-1-(5,6-dihydrobenz…

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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) 1.94 12.38 -48.51 2 8 1 80 458.59 6 ↓
Mid Mid (pH 6-8) 1.94 12.26 -51.22 2 8 1 80 458.59 6 ↓
Mid Mid (pH 6-8) 1.94 10 -17.29 1 8 0 79 457.582 6 ↓

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Rings

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