UCSF

ZINC62933719

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2011 19 Yes

Popular Name: (3S)-1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-3-ethyl-pyrrolidine-3-carboxylic (3S)-1-(6,7-dihydro-5H-cyclopent…

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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) 1.44 9.65 -82.46 2 5 1 72 262.333 3 ↓
Hi High (pH 8-9.5) 1.44 8.37 -49.94 0 5 -1 69 260.317 3 ↓
Mid Mid (pH 6-8) 1.44 9.22 -33.23 1 5 0 70 261.325 3 ↓

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

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