UCSF

ZINC49564718

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 21 Yes

Popular Name: (3S)-N-[(1S)-3-(2-furyl)-1-methyl-propyl]-1,1-dioxo-2,3-dihydrobenzothiophen-3-amine (3S)-N-[(1S)-3-(2-furyl)-1-methy…

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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) 2.46 5.29 -57.28 2 4 1 64 306.407 5 ↓
Mid Mid (pH 6-8) 2.46 4.33 -13.77 1 4 0 59 305.399 5 ↓

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

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