In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 31 | No |
Popular Name: 1-[(4-dimethylaminophenyl)methyl]-3-(4-ethylphenyl)-1-(3-morpholinopropyl)thiourea 1-[(4-dimethylaminophenyl)methyl…
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) | 4.16 | 12.03 | -13.63 | 1 | 5 | 0 | 31 | 440.657 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.16 | 14.32 | -57.43 | 2 | 5 | 1 | 32 | 441.665 | 11 | ↓ |
Lo Low (pH 4.5-6) | 4.16 | 15.07 | -81.14 | 3 | 5 | 0 | 33 | 442.673 | 11 | ↓ |