UCSF

ZINC70006034

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2011 21 Yes

Popular Name: 4-[(2R)-2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]-7H-pyrrolo[2,3-d]pyrimidine 4-[(2R)-2-[(4-methylpyrazol-1-yl…

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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) 1.62 8.97 -11.42 1 6 0 63 282.351 3 ↓
Lo Low (pH 4.5-6) 1.62 9.43 -27.85 2 6 1 64 283.359 3 ↓

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

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