UCSF

ZINC58328433

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 23 Yes

Popular Name: 1-(6-pyrrolidin-1-yl-3-pyridyl)-N-[[(6R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methyl]meth 1-(6-pyrrolidin-1-yl-3-pyridyl)-…

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Download: MOL2 SDF SMILES Flexibase

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) 1.39 6.91 -58.36 3 6 1 63 313.429 5 ↓
Hi High (pH 8-9.5) 1.39 5.54 -11.1 2 6 0 58 312.421 5 ↓
Mid Mid (pH 6-8) 1.39 7.35 -119.49 4 6 2 64 314.437 5 ↓
Lo Low (pH 4.5-6) 1.39 7.51 -175.88 5 6 3 65 315.445 5 ↓

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

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