In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 19 | Yes |
Popular Name: (1S)-1-(4-isopropylphenyl)-N,N-dipropyl-ethane-1,2-diamine (1S)-1-(4-isopropylphenyl)-N,N-d…
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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) | 4.00 | 8.73 | -124.81 | 4 | 2 | 2 | 32 | 264.457 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 7.41 | -45.31 | 3 | 2 | 1 | 31 | 263.449 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 8.31 | -29.36 | 3 | 2 | 1 | 30 | 263.449 | 8 | ↓ |