UCSF

ZINC58344831

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 20 Yes

Popular Name: N,N-dimethyl-1-[[[(6S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methylamino]methyl]cyclopenta N,N-dimethyl-1-[[[(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) 1.53 4.35 -50.57 3 5 1 50 278.424 5 ↓
Mid Mid (pH 6-8) 1.53 6.43 -133.6 4 5 2 51 279.432 5 ↓
Mid Mid (pH 6-8) 1.53 4.51 -95.82 4 5 2 51 279.432 5 ↓
Lo Low (pH 4.5-6) 1.53 6.59 -193.17 5 5 3 52 280.44 5 ↓

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

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