UCSF

ZINC24986453

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 27 Yes

Popular Name: methyl methyl

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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) 3.52 10.32 -12.8 1 7 0 94 387.823 6 ↓
Mid Mid (pH 6-8) 3.97 8.56 -54.21 0 7 -1 97 386.815 6 ↓

Activity (Go SEA)

Rings

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