UCSF

ZINC36204916

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 35 Yes

Popular Name: [(2R)-2-hydroxy-3-[[(7R)-7-methyl-4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl]me [(2R)-2-hydroxy-3-[[(7R)-7-methy…

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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) 2.53 7.69 -60.18 3 9 1 109 507.677 12 ↓
Hi High (pH 8-9.5) 2.53 5.52 -16.37 2 9 0 108 506.669 12 ↓
Hi High (pH 8-9.5) 2.98 5.17 -50.13 2 9 0 112 506.669 12 ↓
Lo Low (pH 4.5-6) 2.53 7.8 -57.86 3 9 1 109 507.677 12 ↓

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