In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 13 | Yes |
Popular Name: (2R)-N2-methyl-N2-[(1S)-1,2,2-trimethylpropyl]butane-1,2-diamine (2R)-N2-methyl-N2-[(1S)-1,2,2-tr…
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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) | 2.05 | 3.32 | -39.55 | 3 | 2 | 1 | 31 | 187.351 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 4.78 | -111.16 | 4 | 2 | 2 | 32 | 188.359 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 4.45 | -26.29 | 3 | 2 | 1 | 30 | 187.351 | 5 | ↓ |