In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 22 | Yes |
Popular Name: N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-1-(4-phenyl-2-furyl)methanamine N-(6,7-dihydro-5H-pyrrolo[2,1-c]…
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) | 1.92 | 9.55 | -53.29 | 2 | 5 | 1 | 60 | 295.366 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 8.2 | -14.81 | 1 | 5 | 0 | 56 | 294.358 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.