In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 27 | No |
Popular Name: 3-(3-chloro-2-methyl-phenyl)-1-(p-tolylmethyl)-1-(3-pyridylmethyl)thiourea 3-(3-chloro-2-methyl-phenyl)-1-(…
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) | 4.63 | 0.5 | -13.44 | 1 | 3 | 0 | 28 | 395.959 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.63 | 0.61 | -50.59 | 2 | 3 | 1 | 29 | 396.967 | 7 | ↓ |