UCSF

ZINC61366033

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 21 Yes

Popular Name: 5,6-dimethyl-7-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrolo[2,3-d]pyrimidin-4-amine 5,6-dimethyl-7-[(4S)-4,5,6,7-tet…

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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) 2.82 9.81 -9.38 2 4 0 57 298.415 1 ↓
Lo Low (pH 4.5-6) 2.82 10.24 -25.34 3 4 1 58 299.423 1 ↓

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

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