In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 15 | Yes |
Popular Name: 1-((2S)PYRROLIDIN-2-YL)-3,5-DICHLORO-2-METHOXYBENZENE 1-((2S)PYRROLIDIN-2-YL)-3,5-DICH…
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) | 3.35 | 5.91 | -40.35 | 2 | 2 | 1 | 26 | 247.145 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 5.03 | -2.35 | 1 | 2 | 0 | 21 | 246.137 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.