UCSF

ZINC65500145

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 25 No

Popular Name: N-(2-dimethylaminoethyl)-5-[(4R)-3-methylthiazolidine-4-carbonyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyra N-(2-dimethylaminoethyl)-5-[(4R)…

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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) -0.54 3.47 -48.75 2 8 1 75 367.499 5 ↓
Hi High (pH 8-9.5) -0.54 0.99 -15.7 1 8 0 74 366.491 5 ↓
Mid Mid (pH 6-8) -0.54 5.19 -90.06 3 8 2 76 368.507 5 ↓

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

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