UCSF

ZINC56738491

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 8th, 2011 30 No

Popular Name: (5S)-cyclopropylmethyl-dihydroxy-3'-methylene-spiro[BLAH-5,5'-tetrahydrofuran]-2'-one (5S)-cyclopropylmethyl-dihydroxy…

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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) 1.13 6.03 -56.06 3 6 1 80 410.49 2 ↓
Hi High (pH 8-9.5) 1.13 4.44 -17.47 2 6 0 79 409.482 2 ↓

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

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