UCSF

ZINC38138247

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2009 33 Yes

Popular Name: (2S)-2-[[4-[2-[(5S)-2,4-diamino-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-5-yl]ethyl-methyl-amino]benzo (2S)-2-[[4-[2-[(5S)-2,4-diamino-…

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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) -1.86 7.95 -126.76 7 12 -1 204 456.483 10 ↓
Lo Low (pH 4.5-6) -1.86 5.98 -78.75 8 12 0 201 457.491 10 ↓

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

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