| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N2-[(R)-(5-chloro-2-thienyl)-(2-furyl)methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[(R)-(5-chloro-2-thienyl…
| 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) | 4.34 | 8.91 | -37.43 | 2 | 3 | 1 | 30 | 327.901 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.34 | 7.31 | -3.36 | 1 | 3 | 0 | 28 | 326.893 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.34 | 10.05 | -112.84 | 3 | 3 | 2 | 34 | 328.909 | 8 | ↓ |
