In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 26 | No |
Popular Name: 1-[(4-chlorophenyl)methyl]-3-(p-tolyl)-1-(3-pyridylmethyl)thiourea 1-[(4-chlorophenyl)methyl]-3-(p-…
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) | 4.28 | 13.41 | -15.79 | 1 | 3 | 0 | 28 | 381.932 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.28 | 13.84 | -59.05 | 2 | 3 | 1 | 29 | 382.94 | 7 | ↓ |