In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 31 | No |
Popular Name: 3-(4-chlorophenyl)-1-(3-pyridylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea 3-(4-chlorophenyl)-1-(3-pyridylm…
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) | 3.46 | 11.89 | -19.37 | 1 | 6 | 0 | 56 | 457.983 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.46 | 12.35 | -59.01 | 2 | 6 | 1 | 57 | 458.991 | 10 | ↓ |