In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: (2R)-2-amino-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-N-methyl-butanamide (2R)-2-amino-N-(6,7-dihydro-5H-p…
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 | 3.94 | -52.76 | 3 | 6 | 1 | 79 | 238.315 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.15 | 3.6 | -21.64 | 2 | 6 | 0 | 77 | 237.307 | 4 | ↓ |