UCSF

ZINC49573476

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 21 Yes

Popular Name: ethyl ethyl

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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) 1.43 6.88 -30.7 1 6 1 65 308.383 7 ↓
Hi High (pH 8-9.5) 1.43 6.48 -14.35 0 6 0 64 307.375 7 ↓
Lo Low (pH 4.5-6) 1.43 8.23 -46.4 1 6 1 65 308.383 7 ↓

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

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