UCSF

ZINC41495973

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 21 No

Popular Name: N-(4-methylpiperazin-1-yl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine N-(4-methylpiperazin-1-yl)-1,3-d…

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Vendors

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) 2.64 8.84 -80.55 3 4 2 34 302.447 2 ↓
Hi High (pH 8-9.5) 2.64 6.07 -6.38 1 4 0 31 300.431 2 ↓
Mid Mid (pH 6-8) 2.64 6.46 -25.72 2 4 1 33 301.439 2 ↓

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

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