In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 28 | No |
Popular Name: 3-(3-chloro-4-methoxy-phenyl)-1-[(2-chlorophenyl)methyl]-1-(1-methyl-4-piperidyl)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) | 4.70 | 12.71 | -43.11 | 2 | 4 | 1 | 29 | 439.432 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.70 | 9.91 | -9.3 | 1 | 4 | 0 | 28 | 438.424 | 7 | ↓ |