UCSF

ZINC65593694

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2011 25 Yes

Popular Name: (6S)-6-[[[(1R)-1-benzyl-2-(dimethylamino)ethyl]amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimi (6S)-6-[[[(1R)-1-benzyl-2-(dimet…

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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) 1.89 8.03 -50.34 3 6 1 70 339.467 7 ↓
Mid Mid (pH 6-8) 1.89 7.03 -57.66 3 6 1 73 339.467 7 ↓
Mid Mid (pH 6-8) 1.89 8.99 -147.41 4 6 2 75 340.475 7 ↓

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

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