UCSF

ZINC58308409

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 24 Yes

Popular Name: N,N-dimethyl-2-[4-[[[(6S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methylamino]methyl]phenoxy N,N-dimethyl-2-[4-[[[(6S)-4,5,6,…

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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) 1.87 7.61 -101.4 4 6 2 60 331.464 8 ↓
Hi High (pH 8-9.5) 1.87 5.09 -58.06 3 6 1 59 330.456 8 ↓
Mid Mid (pH 6-8) 1.87 7.78 -154.04 5 6 3 61 332.472 8 ↓

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

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