In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-N-[(4R)-chroman-4-yl]-1-isopropyl-pyrrolidin-3-amine (3S)-N-[(4R)-chroman-4-yl]-1-iso…
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) | 1.74 | 5.1 | -41.36 | 2 | 3 | 1 | 29 | 261.389 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 4.16 | -3.63 | 1 | 3 | 0 | 24 | 260.381 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 6.66 | -36.14 | 2 | 3 | 1 | 26 | 261.389 | 3 | ↓ |