UCSF

ZINC63752166

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 25 No

Popular Name: (3R)-1-[(2S,7aR)-7-oxo-3,7a-dihydro-2H-thiazolo[4,5-d]pyrimidin-2-yl]-N-(2-furylmethyl)piperidine-3- (3R)-1-[(2S,7aR)-7-oxo-3,7a-dihy…

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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) -0.04 2.04 -19.14 2 8 0 99 361.427 4 ↓
Hi High (pH 8-9.5) -0.04 1.06 -41.34 1 8 -1 101 360.419 4 ↓
Mid Mid (pH 6-8) -0.04 2.24 -52.06 3 8 1 101 362.435 4 ↓
Mid Mid (pH 6-8) -0.04 2.47 -55.13 3 8 1 101 362.435 4 ↓

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

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