UCSF

ZINC69738692

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 24 Yes

Popular Name: 4-[(4-amino-6-methyl-pyrimidin-2-yl)sulfanylmethyl]-6-chloro-7-ethyl-chromen-2-one 4-[(4-amino-6-methyl-pyrimidin-2…

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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) 4.63 9.42 -11.13 2 5 0 82 361.854 4 ↓
Lo Low (pH 4.5-6) 4.63 9.84 -35.52 3 5 1 83 362.862 4 ↓

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

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