In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 32 | Yes |
Popular Name: 5-(hydrocinnamoylamino)-N-(3-pyridylmethyl)-2-pyrrolidino-benzamide 5-(hydrocinnamoylamino)-N-(3-pyr…
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) | 3.23 | 9.93 | -17.41 | 2 | 6 | 0 | 74 | 428.536 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 10.37 | -55.01 | 3 | 6 | 1 | 76 | 429.544 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.