UCSF

ZINC71497593

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 24 Yes

Popular Name: (2R)-2-[(3-methoxyphenyl)methyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)morpholine (2R)-2-[(3-methoxyphenyl)methyl]…

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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) 2.45 8.39 -11.26 1 6 0 63 324.384 4 ↓
Lo Low (pH 4.5-6) 2.45 8.86 -36.71 2 6 1 65 325.392 4 ↓

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

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