UCSF

ZINC65167212

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 28 Yes

Popular Name: (3R)-7-(butanoylamino)-N,N-dimethyl-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxami (3R)-7-(butanoylamino)-N,N-dimet…

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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) 2.15 9.29 -21.84 1 6 0 70 399.516 5 ↓

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

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