In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 24 | No |
Popular Name: 1-cyclopropyl-3-(3,4-dimethoxyphenyl)-1-(3-pyridylmethyl)thiourea 1-cyclopropyl-3-(3,4-dimethoxyph…
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) | 1.77 | 8.2 | -14.97 | 1 | 5 | 0 | 47 | 343.452 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.77 | 8.63 | -53.5 | 2 | 5 | 1 | 48 | 344.46 | 8 | ↓ |