In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2012 | 23 | Yes |
Popular Name: (2S)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-2-methyl-pentanamide (2S)-N-[5-chloro-2-(4-ethylpiper…
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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) | 4.28 | 10.38 | -46.89 | 2 | 4 | 1 | 37 | 338.903 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 8.17 | -6.41 | 1 | 4 | 0 | 36 | 337.895 | 6 | ↓ |