In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (3S)-2-[2-(cyclopropylmethylamino)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide (3S)-2-[2-(cyclopropylmethylamin…
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) | 0.64 | 5.05 | -51.55 | 4 | 5 | 1 | 80 | 288.371 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.64 | 3.67 | -11.5 | 3 | 5 | 0 | 75 | 287.363 | 5 | ↓ |