In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 19 | Yes |
Popular Name: 4-amino-N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1H-pyrrole-2-carboxamide 4-amino-N-[1-(2-amino-2-oxo-ethy…
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) | -1.15 | -1.29 | -46.68 | 7 | 7 | 1 | 118 | 266.325 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.59 | -3.14 | -96.76 | 7 | 7 | 2 | 117 | 267.333 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.