In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 14 | No |
Popular Name: (1S,8S)-N-[(3R)-tetrahydrothiophen-3-yl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (1S,8S)-N-[(3R)-tetrahydrothioph…
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) | 1.28 | 5.62 | -34.28 | 2 | 2 | 1 | 16 | 213.37 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 3.86 | -42.26 | 2 | 2 | 1 | 20 | 213.37 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 6.44 | -109.53 | 3 | 2 | 2 | 21 | 214.378 | 2 | ↓ |