In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 29 | No |
Popular Name: 1-[(2-chlorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-(1-methyl-4-piperidyl)thiourea 1-[(2-chlorophenyl)methyl]-3-(3,…
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) | 3.69 | 12.06 | -43.52 | 2 | 5 | 1 | 38 | 435.013 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.69 | 9.26 | -11.61 | 1 | 5 | 0 | 37 | 434.005 | 8 | ↓ |