In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 26 | No |
Popular Name: 3-(4-chlorophenyl)-1-[(2-chlorophenyl)methyl]-1-(3-pyridylmethyl)thiourea 3-(4-chlorophenyl)-1-[(2-chlorop…
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) | 4.46 | -0.37 | -14.73 | 1 | 3 | 0 | 28 | 402.35 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.46 | -0.26 | -51.12 | 2 | 3 | 1 | 29 | 403.358 | 7 | ↓ |