In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 23 | Yes |
Popular Name: (2S,4R)-4-(benzylamino)-1-isopropyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide (2S,4R)-4-(benzylamino)-1-isopro…
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) | 1.40 | 3.88 | -55.99 | 3 | 5 | 1 | 58 | 320.457 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 4.76 | -33.19 | 3 | 5 | 1 | 55 | 320.457 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 6.22 | -116.23 | 4 | 5 | 2 | 59 | 321.465 | 8 | ↓ |