UCSF

ZINC71555626

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 26 Yes

Popular Name: (2S)-2-methyl-N-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)-3-oxo-4H-1,4-benzoxazine-6-sul (2S)-2-methyl-N-(5-methyl-6,7-di…

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Vendors

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) 2.40 1.04 -15.29 2 8 0 104 394.478 2 ↓
Mid Mid (pH 6-8) 2.40 3.47 -58.02 3 8 1 105 395.486 2 ↓
Mid Mid (pH 6-8) 1.47 0.56 -45.76 1 8 -1 103 393.47 3 ↓
Lo Low (pH 4.5-6) 1.47 3.02 -59.19 2 8 0 104 394.478 3 ↓

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Rings

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

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