In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 20 | No |
Popular Name: 1-[(1R)-1-methyl-3-phenyl-propyl]-3-(3-pyridyl)thiourea 1-[(1R)-1-methyl-3-phenyl-propyl…
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) | 2.93 | -1.85 | -11.82 | 2 | 3 | 0 | 36 | 285.416 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.93 | -1.75 | -41.21 | 3 | 3 | 1 | 38 | 286.424 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.