In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | No |
Popular Name: (3R)-3-(aminomethyl)-N-[(3R)-1,1-dioxothiolan-3-yl]-1-isopropyl-N-methyl-pyrrolidin-3-amine (3R)-3-(aminomethyl)-N-[(3R)-1,1…
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) | -0.44 | 1.98 | -118.14 | 4 | 5 | 2 | 69 | 291.461 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.44 | -1.34 | -57.07 | 3 | 5 | 1 | 68 | 290.453 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.44 | -0.01 | -47.19 | 3 | 5 | 1 | 68 | 290.453 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.44 | 0.31 | -126.16 | 4 | 5 | 2 | 69 | 291.461 | 4 | ↓ |