In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 27 | No |
Popular Name: 3-(2-chlorophenyl)-1-(3-morpholinopropyl)-1-(4-pyridylmethyl)thiourea 3-(2-chlorophenyl)-1-(3-morpholi…
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) | 2.48 | 9.34 | -13.83 | 1 | 5 | 0 | 41 | 404.967 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 11.6 | -49.02 | 2 | 5 | 1 | 42 | 405.975 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.48 | 12.06 | -99.56 | 3 | 5 | 2 | 43 | 406.983 | 9 | ↓ |