In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 30 | Yes |
Popular Name: 1-[2-(dipentylamino)ethylamino]-4-methyl-thioxanthen-9-one 1-[2-(dipentylamino)ethylamino]-…
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) | 8.42 | 14.81 | -94.49 | 3 | 3 | 2 | 39 | 426.67 | 11 | ↓ |
Hi High (pH 8-9.5) | 8.42 | 12.64 | -24.52 | 2 | 3 | 1 | 37 | 425.662 | 11 | ↓ |