UCSF

ZINC41667010

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 33 Yes

Popular Name: propyl propyl

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Annotations

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Vendors

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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) 3.21 7.96 -15.01 0 8 0 81 458.555 10 ↓
Mid Mid (pH 6-8) 3.21 10.82 -52.37 1 8 1 83 459.563 10 ↓
Mid Mid (pH 6-8) 3.21 10.22 -50.14 1 8 1 83 459.563 10 ↓
Lo Low (pH 4.5-6) 3.21 13.1 -124.47 2 8 2 84 460.571 10 ↓

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