In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 29 | No |
Popular Name: 3-(3-chloro-4-methoxy-phenyl)-1-(3-morpholinopropyl)-1-(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) | 2.57 | 8.56 | -17.31 | 1 | 6 | 0 | 50 | 434.993 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 10.89 | -53.35 | 2 | 6 | 1 | 51 | 436.001 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.57 | 11.33 | -114.58 | 3 | 6 | 2 | 52 | 437.009 | 10 | ↓ |