UCSF

ZINC61327797

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2011 16 Yes

Popular Name: N-ethyl-5,6-dihydrothieno[2,3-h]cinnolin-3-amine N-ethyl-5,6-dihydrothieno[2,3-h]…

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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) 2.63 5.82 -10.91 1 3 0 38 231.324 2 ↓
Mid Mid (pH 6-8) 2.63 5.97 -28.36 2 3 1 39 232.332 2 ↓
Mid Mid (pH 6-8) 2.63 5.94 -25.08 2 3 1 39 232.332 2 ↓

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Rings

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

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