UCSF

ZINC36753780

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2009 18 Yes

Popular Name: 5-[(4-aminopiperidin-1-yl)sulfonyl]pyrimidine-2,4(1H,3H)-dione hydrochloride 5-[(4-aminopiperidin-1-yl)sulfon…

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Other Names:

MFCD12434019

MFCD24387792

Download: MOL2 SDF SMILES Flexibase

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) -1.71 -5.25 -64.01 4 8 0 134 274.302 2 ↓
Mid Mid (pH 6-8) -2.17 -3.51 -59.35 5 8 1 131 275.31 2 ↓
Mid Mid (pH 6-8) -1.71 -6.07 -72.57 4 8 0 134 274.302 2 ↓

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

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