In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 19 | Yes |
Popular Name: (3R,4S)-N3-(cyclopropylmethyl)-N3-isopropyl-chromane-3,4-diamine (3R,4S)-N3-(cyclopropylmethyl)-N…
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) | 0.86 | 4.68 | -44.31 | 3 | 3 | 1 | 40 | 261.389 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 4.42 | -3.33 | 2 | 3 | 0 | 38 | 260.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 6.7 | -34.13 | 3 | 3 | 1 | 40 | 261.389 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 6.99 | -119.87 | 4 | 3 | 2 | 41 | 262.397 | 4 | ↓ |