In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 27 | No |
Popular Name: 3-(3-chloro-4-methoxy-phenyl)-1,1-bis(3-pyridylmethyl)thiourea 3-(3-chloro-4-methoxy-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) | 2.58 | 10.35 | -15.99 | 1 | 5 | 0 | 50 | 398.919 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.58 | 10.78 | -58.77 | 2 | 5 | 1 | 52 | 399.927 | 8 | ↓ |