In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 29 | No |
Popular Name: 3-(2-chloro-4-methyl-phenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea 3-(2-chloro-4-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) | 4.01 | 15.83 | -39.56 | 2 | 5 | 1 | 44 | 429.997 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.01 | 15.32 | -14.52 | 1 | 5 | 0 | 42 | 428.989 | 10 | ↓ |