UCSF

ZINC67514080

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 18 Yes

Popular Name: N-methyl-N-[2-(1H-pyrazol-4-yl)ethyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine N-methyl-N-[2-(1H-pyrazol-4-yl)e…

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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) 0.89 6.24 -11.82 2 6 0 73 242.286 4 ↓
Lo Low (pH 4.5-6) 0.89 6.71 -34.15 3 6 1 75 243.294 4 ↓

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

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