In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 22 | No |
Popular Name: 3-(3-chloro-2-methyl-phenyl)-1-cyclopropyl-1-(4-pyridylmethyl)thiourea 3-(3-chloro-2-methyl-phenyl)-1-c…
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) | 3.10 | 10.23 | -10.29 | 1 | 3 | 0 | 28 | 331.872 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 10.68 | -39.33 | 2 | 3 | 1 | 29 | 332.88 | 6 | ↓ |