In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2004 | 29 | No |
Popular Name: 3-(3-chlorophenyl)-1-(3-pyridylmethyl)-1-veratryl-thiourea 3-(3-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 | 0.04 | -17.69 | 1 | 5 | 0 | 47 | 427.957 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.46 | 12.09 | -58.98 | 2 | 5 | 1 | 48 | 428.965 | 9 | ↓ |