UCSF

ZINC58314881

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 23 Yes

Popular Name: (4R)-1-phenyl-4-[[(6S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methylamino]pyrrolidin-2-one (4R)-1-phenyl-4-[[(6S)-4,5,6,7-t…

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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) 1.09 6.18 -74.72 3 6 1 67 312.397 4 ↓
Hi High (pH 8-9.5) 1.09 5.14 -15.02 2 6 0 62 311.389 4 ↓
Mid Mid (pH 6-8) 1.09 6.34 -121.58 4 6 2 68 313.405 4 ↓

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

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